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> Main
CHEBI:393747 - 3,4-dichlorophenoxyacetic acid
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ChEBI Name
3,4-dichlorophenoxyacetic acid
ChEBI ID
CHEBI:393747
Definition
A chlorophenoxyacetic acid that is phenoxyacetic acid in which the hydrogens at positions 3 and 4 of the phenyl group are replaced by chlorines.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C8H6Cl2O3
Net Charge
0
Average Mass
221.03700
Monoisotopic Mass
219.96940
InChI
InChI=1S/C8H6Cl2O3/c9-6-2-1-5(3-7(6)10)13-4-8(11)12/h1-3H,4H2,(H,11,12)
InChIKey
SNYRXHULAWEECU-UHFFFAOYSA-N
SMILES
OC(=O)COc1ccc(Cl)c(Cl)c1
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Application
(s):
phenoxy herbicide
Any member of the class of herbicides whose members contain a phenoxy or substituted phenoxy group.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
3,4-dichlorophenoxyacetic acid (
CHEBI:393747
)
has role
phenoxy herbicide (
CHEBI:60575
)
3,4-dichlorophenoxyacetic acid (
CHEBI:393747
)
is a
chlorophenoxyacetic acid (
CHEBI:23152
)
IUPAC Name
(3,4-dichlorophenoxy)acetic acid
Synonym
Source
3,4-DA
ChemIDplus
Registry Numbers
Types
Sources
1969638
Reaxys Registry Number
Reaxys
588-22-7
CAS Registry Number
ChemIDplus
Last Modified
18 November 2019