CHEBI:38729 - naled

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ChEBI Name naled
ChEBI ID CHEBI:38729
Definition An dialkyl phosphate resulting from the formal condensation of the acidic hydroxy group of dimethyl hydrogen phosphate with the alcoholic hydroxy group of 1,2-dibromo-2,2-dichloroethanol. An organophosphate insecticide, it is no longer approved for use within the European Union.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C4H7Br2Cl2O4P
Net Charge 0
Average Mass 380.78400
Monoisotopic Mass 377.783
InChI InChI=1S/C4H7Br2Cl2O4P/c1-10-13(9,11-2)12-3(5)4(6,7)8/h3H,1-2H3
InChIKey BUYMVQAILCEWRR-UHFFFAOYSA-N
SMILES COP(=O)(OC)OC(Br)C(Cl)(Cl)Br
Roles Classification
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
EC 3.1.1.7 (acetylcholinesterase) inhibitor
An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid.
EC 3.1.1.8 (cholinesterase) inhibitor
An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8).
antibacterial agent
A substance that kills or slows the growth of bacteria.
Application(s): acaricide
A substance used to destroy pests of the subclass Acari (mites and ticks).
agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
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 organophosphorus 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 organophosphorus pesticide )
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ChEBI Ontology
Outgoing naled (CHEBI:38729) has role acaricide (CHEBI:22153)
naled (CHEBI:38729) has role agrochemical (CHEBI:33286)
naled (CHEBI:38729) has role antibacterial agent (CHEBI:33282)
naled (CHEBI:38729) has role antifungal agent (CHEBI:35718)
naled (CHEBI:38729) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
naled (CHEBI:38729) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
naled (CHEBI:38729) is a dialkyl phosphate (CHEBI:16648)
naled (CHEBI:38729) is a organobromine compound (CHEBI:37141)
naled (CHEBI:38729) is a organochlorine compound (CHEBI:36683)
naled (CHEBI:38729) is a organophosphate insecticide (CHEBI:25708)
IUPAC Name
1,2-dibromo-2,2-dichloroethyl dimethyl phosphate
Synonyms Sources
dimethyl-1,2-dibromo-2,2-dichloroethyl phosphate Patent
O,O-dimethyl O-2,2-dichloro-1,2-dibromoethyl phosphate ChemIDplus
O-(1,2-dibromo-2,2-dichloroethyl)-O,O-dimethyl phosphate NIST Chemistry WebBook
phosphoric acid, 1,2-dibromo-2,2-dichloroethyl dimethyl ester ChemIDplus
Brand Names Sources
Bromex ChemIDplus
Dibrom ChemIDplus
Ortho-Dibrom NIST Chemistry WebBook
Manual Xrefs Databases
480 PPDB
C18749 KEGG COMPOUND
GB855157 Patent
naled Alan Wood's Pesticides
Naled Wikipedia
US2971882 Patent
View more database links
Registry Numbers Types Sources
2049930 Beilstein Registry Number Beilstein
300-76-5 CAS Registry Number ChemIDplus
300-76-5 CAS Registry Number NIST Chemistry WebBook
Last Modified
07 July 2015