CHEBI:27841 - DDD

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ChEBI Name DDD
ChEBI ID CHEBI:27841
Definition A chlorophenylethane that is 2,2-bis(p-chlorophenyl)ethane substituted by two chloro groups at position 1. It is a metabolite of the organochlorine insecticide, DDT.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:18850, CHEBI:473
Supplier Information No supplier information found for this compound.
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Ethanol (also called ethyl alcohol, grain alcohol, drinking alcohol, or simply alcohol) is an organic compound with the chemical formula CH3CH2OH. It is an alcohol, with its formula also written as C2H5OH, C2H6O or EtOH, where Et stands for ethyl. Ethanol is a volatile, flammable, colorless liquid with a characteristic wine-like odor and pungent taste. As a psychoactive depressant, it is the active ingredient in alcoholic beverages, and the second most consumed drug globally behind caffeine. Ethanol is naturally produced by the fermentation process of sugars by yeasts or via petrochemical processes such as ethylene hydration. Historically it was used as a general anesthetic, and has modern medical applications as an antiseptic, disinfectant, solvent for some medications, and antidote for methanol poisoning and ethylene glycol poisoning. It is used as a chemical solvent and in the synthesis of organic compounds, and as a fuel source for lamps, stoves, and internal combustion engines. Ethanol also can be dehydrated to make ethylene, an important chemical feedstock. As of 2023, world production of ethanol fuel was 29,590,000,000 US gallons (112.0 gigalitres), coming mostly from the U.S. (51%) and Brazil (26%).
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Formula C14H10Cl4
Net Charge 0
Average Mass 320.04000
Monoisotopic Mass 317.95366
InChI InChI=1S/C14H10Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8,13-14H
InChIKey AHJKRLASYNVKDZ-UHFFFAOYSA-N
SMILES ClC(Cl)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Roles Classification
Biological Role(s): xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound.
Application(s): insecticide
Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.
(via organochlorine insecticide )
pesticide
Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
(via organochlorine pesticide )
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ChEBI Ontology
Outgoing DDD (CHEBI:27841) has role xenobiotic metabolite (CHEBI:76206)
DDD (CHEBI:27841) is a chlorophenylethane (CHEBI:23154)
DDD (CHEBI:27841) is a monochlorobenzenes (CHEBI:83403)
DDD (CHEBI:27841) is a organochlorine insecticide (CHEBI:25705)
IUPAC Name
1,1'-(2,2-dichloroethane-1,1-diyl)bis(4-chlorobenzene)
Synonyms Sources
1,1'-(2,2-dichloroethylidene)bis[4-chlorobenzene] UM-BBD
1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethane KEGG COMPOUND
1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethane KEGG COMPOUND
1,1-dichloro-2,2-bis(p-chlorophenyl)ethane NIST Chemistry WebBook
DDD KEGG COMPOUND
Dichlorodiphenyldichloroethane KEGG COMPOUND
Dilene ChemIDplus
p,p'-DDD NIST Chemistry WebBook
p,p'-TDE NIST Chemistry WebBook
Rhothane ChemIDplus
TDE ChemIDplus
tetrachlorodiphenylethane NIST Chemistry WebBook
Manual Xrefs Databases
755 PPDB
c0505 UM-BBD
C06636 KEGG COMPOUND
Dichlorodiphenyldichloroethane Wikipedia
View more database links
Registry Numbers Types Sources
1914072 Reaxys Registry Number Reaxys
509095 Gmelin Registry Number Gmelin
72-54-8 CAS Registry Number KEGG COMPOUND
72-54-8 CAS Registry Number NIST Chemistry WebBook
72-54-8 CAS Registry Number ChemIDplus
Citations Types Sources
19487035 PubMed citation Europe PMC
21007656 PubMed citation Europe PMC
9496653 PubMed citation Europe PMC
Last Modified
16 July 2015