Chemical classification

Some pesticides have similar properties based on their chemical structure. Such chemicals belong to the same chemical class and frequently have similar toxicological modes of action. This page gives brief descriptions of the different chemical classes and provides representative chemical structures for most classes.

Pesticides BulletChemical Class Descriptions
Pesticides BulletRepresentative Chemical Structures

Pesticides BulletInsecticides
Pesticides BulletHerbicides
Pesticides BulletMicrobiocides
pesticides bulletFungicides
Pesticides BulletRodenticides

Pesticides BulletAbout the Data: Accuracy, Currency, Comprehensiveness and Source


Chemical Class Descriptions (alphabetical)
Chemical Class
Description
1,3-Indandione
Rodenticides that act as anticoagulants. High acute toxicity. Indandione structure, with substituents. Representative chemical structure here.
2,6-Dinitroaniline
Herbicidal compounds containing a dinitroaniline functional group. While these compounds are not acutely toxic to animals, many of them are possible human carcinogens. Representative chemical structure here.
Alkyl phthalate
Compounds derived from phthalic acid. Used as insecticides and insect repellents, as well as softeners in plastics manufacturing. Some of these compounds are suspected endocrine disruptors. Representative chemical structure here.
Anilide
Herbicidal compounds with an anilide functional group. These compounds have potential to leach into groundwater. Examples are propanil and flufenacet. Representative chemical structure here.
Azole
Fungicidal compounds, a few of which are carcinogenic. Representative chemical structures here.
Benzimidazole
Fungicidal compounds with a benzimidazole group. Benomyl and thiabendazole are examples. Representative chemical structure here.
Benzoic acid
Compounds with a benzoic acid functional group. Many of these are herbicides. Examples are chloramben and dicamba. Representative chemical structures here.
Benzoyl urea
Herbicidal compounds with a urea functional group having a benzoyl substituent. Frequently found as groundwater contaminants. Diflubenzuron and Triflumuron are examples. Representative chemical structure here.
Bipyridilium
Herbicides containing two pyridine rings, joined through a C-C bond. Most are acutely toxic to mammals. Paraquat is a bipyridilium compound. Representative chemical structures here.
Bis-Carbamate
Compounds containing two carbamate moieties. Typically herbicides. Representative chemical structure here.
Botanical
Pesticides derived from plants. These pesticides are typically a plant's natural defense against insects or fungi. Examples are nicotine and pyrethrins. Some of these compounds are quite toxic.
Carboxamide
Fungicidal compounds. Carboxin and flutolanil are examples. Representative chemical structure here.
Chelating agent
A compound that binds tightly to metal ions, generally increasing the water solubility of the ion. Chelation can also reduce the bioavailability of a metal ion by making it less reactive in biological systems. EDTA is the most widely used chelating agent in pesticide formulations.
Chlorinated phenol
Chlorinated aromatic alcohols typically used as microbiocides, fungicides, algaecides, or wood preservatives. Some of these compounds are carcinogenic and/or extremely toxic. Representative chemical structure here.
Chloroacetanilide
Herbicidal compounds with a chloroacetanilide functional group. These compounds are frequently found with their breakdown products as contaminants in groundwater. Examples are alachlor and metolachlor. Representative chemical structures here.
Chlorophenoxy acid/ ester
Herbicidal compounds such as 2,4-D and 2,4,5-T. Many chlorophenoxy compounds are suspected endocrine disruptors. Representative chemical structure here.
Chloropyridinyl
Triclopyr and its salts are members of this chemical class of herbicidal compounds.These compounds are commonly used on new-growth forests. Structure of the parent compound here.
Coumarin
Rodenticides that act as anticoagulants. Cinnamic acid lactone structure. Representative chemical structure here.
Cyclohexenone
A relatively new class of herbicidal compounds. While most have not been thoroughly evaluated, tralkoxydim has been rated as a Likely carcinogen by the U.S. EPA. Representative chemical structure here.
Diacylhydrazine
A relatively new class of insecticide that is persistent in the environment and may pose substantial ecological risks. Methoxyfenozide and tebufenozide are examples. There is some evidence these compounds may be endocrine disruptors. Representative chemical structure here.
Dicarboximide
Fungicidal compounds. Vinclozolin and iprodione are examples. Representative chemical structure here.
Dinitrophenol
Herbicidal and fungicidal compounds. Many are very acutely toxic, as well as being reproductive and developmental toxicants. Representative chemical structure here.
Dithiocarbamate
Typically fungicides with a carbamate structure where sulfurs replace both oxygens in the amide functional group. Examples are maneb, metam sodium, and ziram. These compounds are not cholinesterase inhibitors. Representative chemical structures here.
Halogenated organic
A diverse array of compounds composed mainly of carbon, hydrogen, and fluorine, chlorine, and/or bromine. Used as fumigants, fungicides, solvents and propellants.
Imidazolinone
A relatively new class of herbicidal compounds, with low acute toxicity to animals. Representative chemical structure here.
Inorganic
Any chemical compound not containing hydrocarbon moieties and not one of the toxic metals. Inorganic compounds of toxic metals--mercury, arsenic, cadmium, chromium, tin, lead, and silver--are listed separately (see below). Examples of inorganics are lime, phosphoric acid, and sulfuryl fluoride.
Inorganic-Arsenic
Arsenic-containing compounds that do not have arsenic-carbon bonds. These compounds are generally extremely toxic, causing acute toxicity, cancer, and developmental toxicity.
Inorganic-Cadmium
Cadmium-containing compounds that do not have cadmium-carbon bonds. These compounds are generally extremely toxic, causing acute toxicity, cancer, reproductive and developmental toxicity.
Inorganic-Chromium (VI)
Chromium-containing compounds that do not have chromium-carbon bonds, where the chromium atom is hexavalent (Cr+6). These compounds are extremely toxic, causing acute poisoning, cancer, reproductive and developmental toxicity.
Inorganic-Lead
Lead-containing compounds that do not have lead-carbon bonds. These compounds are extremely toxic, causing acute neurotoxicity, cancer, reproductive and developmental toxicity.
Inorganic-Mercury
Mercury-containing compounds that do not have mercury-carbon bonds. These compounds are generally extremely toxic, causing acute toxicity, cancer, and developmental toxicity.
Inorganic-Silver
Silver-containing compounds that do not have silver-carbon bonds. Most are used as microbiocides.
Inorganic-Zinc
Zinc-containing compounds that do not have zinc-carbon bonds. Most are used as microbiocides or fungicides.
Microbial
Pesticides composed of a particular species of microbe, e.g. Bacillus thuringiensis. Generally, these microbes produce a toxin that is the "active ingredient" that kills a pest. Microbial pesticides are typically very selective, affecting only the target pest.
N-Methyl carbamate
Compounds (mostly insecticides) with an N-methyl amide functional group. Most N-methyl carbamates are strong cholinesterase inhibitors which cause neurotoxicity in both insects and humans. N-methyl carbamates are the most acutely toxic of all carbamate pesticides. Representative chemical structure here.
Naphthalene acetic acid
Plant growth regulators with low acute toxicity. Representative chemical structures here.
Oil - essential
Oils with pesticidal properties extracted from plants. Examples are cinnamon, peppermint, jasmine, and lavender oils.
Oil - vegetable
Oils extracted from plants such as soybeans and corn and used as insecticides. They work by smothering the insects.
Organoarsenic
Arsenic-containing compounds with an organic moiety bound directly to arsenic. These compounds are generally extremely toxic, with many used as chemical warfare agents.
Organochlorine
Compounds, mostly insecticides, composed primarily of carbon, hydrogen, and chlorine. Organochlorines are typically very persistent in the environment and are known for bioaccumulating or building up in sediments, plants and animals. Many organochlorines are also suspected endocrine disruptors. Representative chemical structures here.
Organomercury
Mercury-containing compounds with an organic moiety bound directly to mercury. These compounds are generally extremely toxic, causing acute toxicity, cancer, and developmental toxicity.
Organophosphorus
Compounds, mostly insecticides, that contain a phosphorus atom bound to organic substituents, either alkyl or alkoxy groups. Most organo-phosphorus pesticides are cholinesterase inhibitors which cause neurotoxicity in both insects and humans. Representative chemical structures here.
Organotin
Tin-containing compounds with an organic moiety bound directly to tin. These compounds are generally extremely acutely toxic and are also known to be endocrine disruptors. Examples are tributyltin or triphenyltin salts.
Other carbamate
Compounds (mostly insecticides) with an amide functional group with substituents besides methyl groups. Many of these carbamates are mild cholinesterase inhibitors which cause neurotoxicity in both insects and humans. Representative chemical structure here.
Petroleum derivative
Compounds derived from crude oil through a distillation process. Frequently used as solvents, adjuvants, and insecticides. Depending on the level of refinement, petroleum derivatives often contain carcinogenic substances.
Pheromone
Insect sex-attractant hormones used to disrupt mating. These compounds are used in very small quantities and are very selective for a particular insect species. Their chemical structure is typically a long-chain alcohol, aldehyde or ester with at least one double bond. Representative chemical structures here. Cornell University hosts an excellent web site on pheromones.
Phosphonoglycine
Herbicidal organophosphorus compound. These compounds inhibit a plant-specific enzyme and have low acute toxicity to mammals. Glyphosate and its salts and esters (active ingredients in Roundup products) belong to this class of compounds. Representative structure here.
Pyrazole
A relatively new class of insecticide that is persistent in the environment and may pose substantial ecological risks. Chlorfenapyr (Pirate) is an example. Representative chemical structure here.
Pyrethroid
Synthetic insecticides (typically cyclopropane carboxylates) structurally similar to pyrethrins, which are naturally occurring insecticidal compounds. Many pyrethroids are suspected endocrine disruptors. Representative chemical structures here.
Pyridinecarboxylic acid
Herbicidal compounds with low acute toxicity. Representative chemical structure here.
Quaternary ammonium
Ammonium salts with four alkyl or aryl groups, typically used as microbiocides or algaecides. Representative chemical structure here.
Silicone
Synthetic oils with a silicon-oxygen backbone. Used as antifoaming agents and emulsifiers.
Soap
Compounds with surfactant or detergent properties. Used as insecticides and adjuvants.
Substituted benzene
Fungicidal compounds with a benzene ring substituted with various substituents. Some of these compounds are very toxic wood preservatives such as pentachloro-nitrobenzene (PCNB) and hexachlorobenzene. Representative chemical structure here.
Sulfonyl urea
Herbicidal compounds with a urea functional group having a sulfonyl substituent. Frequently found as groundwater contaminants. Bensulfuron-methyl and rimsulfuron are examples. Representative chemical structure here.
Thiocarbamate
Typically herbicides with a carbamate structure where sulfur replaces one of the oxygens in the amide functional group. Examples are cycloate, butylate, and molinate. These compounds are weak cholinesterase inhibitors. Representative chemical structure here.
Triazine
Typically herbicides or microbiocides containing a triazine ring. Frequently found in groundwater, along with their transformation products. Representative chemical structure here.
Uracil
Herbicidal compounds derived from uracil. Frequently found as groundwater contaminants. Bromacil and terbacil are examples. Representative chemical structure here.
Urea
Herbicidal compounds with a urea functional group. Frequently found as groundwater contaminants. Diuron and linuron are examples. Some of these compounds are carcinogenic. Representative chemical structures here.

 


Coming soon

Fungicides:
  • Mercaptobenzothiazole
  • Pyrimidine
  • Substituted Benzene
  • Thiophthalimide
  • Strobin
Herbicides:
  • Amide
  • Phosphinico amino acid
Microbiocides/Wood Preservatives (mostly):
  • Alkyl Amino Propane
  • Chlorinated Phenol
  • Hydantoin
  • Isothiazolone
  • Phenol
  • Quaternary Ammonium Compounds
Oils, soaps, solvents, adjuvants:
  • Alcohol/Ether
  • Polyalkoxy Compound
Other:
  • Carbohydrate
  • Cellulose derivative

Representative Chemical Structures

Insecticides

pesticides bulletAlkyl Phthalates
pesticides bulletChloronicotinyl Compounds
Pesticides BulletDiacylhydrazines
Pesticides BulletN-Methyl Carbamates
Pesticides BulletOrganochlorine Compounds
Pesticides BulletOrganophosphorus Compounds
Pesticides BulletOther Carbamates
pesticides bulletPheromones
Pesticides BulletPyrazoles
Pesticides BulletPyrethroids

Herbicides

Pesticides Bullet2,6-Dinitroanilines
Pesticides BulletAnilides
Pesticides BulletAryoxyphenoxy proprionic acids
Pesticides BulletBenzoic Acids
Pesticides BulletBenzoyl Ureas
Pesticides BulletBipyridilium Compounds
Pesticides BulletBis-Carbamates
Pesticides BulletChloroacetanilide
Pesticides BulletChlorophenoxy Acids/Esters
Pesticides BulletChloropyridinyls
Pesticides BulletCyclohexenones
Pesticides BulletDinitrophenols
pesticides bulletImidazolinones
Pesticides BulletNaphthalene Acetic Acid Derivatives
Pesticides BulletPhosphonoglycines
Pesticides BulletPyridinecarboxylic Acids
Pesticides BulletSulfonyl Ureas
Pesticides BulletThiocarbamates
Pesticides BulletTriazines
Pesticides BulletUreas
Pesticides BulletUracils

Microbiocides

Pesticides BulletChlorinated Phenols
Pesticides BulletHydantoins
Pesticides BulletIsothiazolones
Pesticides BulletPhenols
Pesticides BulletQuaternary Ammonium Compounds

Fungicides

Pesticides BulletAzoles
Pesticides BulletBenzimidazoles
Pesticides BulletCarboxamides
Pesticides BulletDicarboximides
Pesticides BulletDithiocarbamates
Pesticides BulletSubstituted Benzenes

Rodenticides

Pesticides BulletCoumarins
Pesticides Bullet1,3-Indandiones


Alkyl Phthalates

Pesticides chemical structures Alkyl phthalate

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Chloronicotinyl Compounds

Pesticides chemical structures chloronicotinyl

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Diacylhydrazines

Pesticides chemical structures Diacylhydrazine

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N-Methyl Carbamates

Pesticides chemical structures N-Methyl Carabamate

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Organochlorine Compounds

Organochlorine compounds do not have a common chemical structure, but all of them have multiple carbon-chlorine bonds.

 

Pesticides chemical structures Organochlorines

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Organophosphorus Compounds

The general chemical structures associated with organophosphorus pesticides are:

Pesticides chemical structures Organophosphates (OPs)

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  Other Carbamates

Pesticides chemical structures Carbamates

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Pheromones

Many pheromones have a long-chain alkyl component with one or more double bonds and a terminal alcohol, ester, or aldehyde functional group.

Pesticides chemical structures Pheromones

Others are more variable in structure. Some examples are shown below.

Pesticides chemical structures Pheromones

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Pyrazoles

Pesticides chemical structures Pyrazoles

 

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Pyrethroids

Pesticides chemical structures Pyrethroids

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    2,6-Dinitroanilines

Pesticides chemical structures 2,6-dinitroaniline

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Anilides  

Pesticides chemical structures Acetanilides

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Aryloxyphenoxy proprionic acids

Pesticides chemical structures Aryloxyphenoxy

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Benzoic Acids

Pesticides chemical structures Benzoic Acids

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Benzoyl Ureas

Pesticides chemical structures Benzoyl Ureas

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Bipyridilium Compounds

Pesticides chemical structures Bipyridilium

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Bis-Carbamates

Pesticides chemical structures Bis-Carbamates

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Chlorophenoxy Acids/Esters

Pesticides chemical structures Chlorophenoxys

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Chloroacetanilide

Pesticides chemical structures Chlorophenoxys

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Chloropyridinyl

Pesticides chemical structures Chloropyridinyls

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Cyclohexenones

Pesticides chemical structures Cyclohexenones

 

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Dinitrophenols

Pesticides chemical structures DNP

 

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Imidazolinone

Pesticides chemical structures Imidazolidiones

 

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Naphthalene Acetic Acid Derivatives

 

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Phosphonoglycines

Pesticides chemical structures Phosphonoglycines

 

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  Pyridinecarboxylic Acids 

Pesticides chemical structures Pyridinecarboxs

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Sulfonyl Ureas

Pesticides chemical structures sulfonyl ureas

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Thiocarbamates

Pesticides chemical structures thiocarbamates

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Triazines

Pesticides chemical structures triazines

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Ureas

The general structure is a urea unit with substituents:

Pesticides chemical structures ureas

Some specific examples are diuron and tebuthiuron.

Pesticides chemical structures ureas

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Uracils

Pesticides chemical structures uracils

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Chlorinated Phenols

Pesticides chemical structures chloronated phenols

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Quaternary Ammonium Salts

Pesticides chemical structures ammonia quaternaries

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Azoles

Pesticides chemical structures azoles

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Benzimidazoles

Pesticides chemical structures benzimidazoles

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Carboxamides

Pesticides chemical structures carboxamides

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Dicarboximides

Pesticides chemical structures dicarboximides

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Dithiocarbamates

Pesticides chemical structures dithiocarbamates

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Substituted Benzenes

Pesticides chemical structures substitued benzenes

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Coumarins

Pesticides chemical structures coumarins

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1,3-Indandiones

Pesticides chemical structures indandiones

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About the Data: Accuracy, currency, comprehensiveness and source

This dataset is maintained by PAN staff by evaluation of chemical structure, and research using the references listed below. Last updated December 11, 2003. PAN staff will continue to add to this list and update it at least annually.

References:

  1. Chem Finder, CambridgeSoft Corporation. Viewed on April 8, 2005.
  2. The Pesticide Manual, 11th edition, C. D. S. Tomlin, Ed., British Crop Protection Council (Farnham, Surrey, UK, 1997).
  3. Merck Index, 12th edition, Merck Publishing Group (Rahway, NJ, 1996).
  4. A. Wood, Compendium of Pesticide Common Names, Copyright © 1995-2003. Viewed on April 8, 2005.

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Last updated April 7, 2005 .