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CHEBI:19984 - 3-chlorobenzoate
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ChEBI Name
3-chlorobenzoate
ChEBI ID
CHEBI:19984
Definition
A chlorobenzoate that is the conjugate base of 3-chlorobenzoic acid.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C7H4ClO2
Net Charge
-1
Average Mass
155.55816
Monoisotopic Mass
154.99053
InChI
InChI=1S/C7H5ClO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)/p-1
InChIKey
LULAYUGMBFYYEX-UHFFFAOYSA-M
SMILES
[O-]C(=O)c1cccc(Cl)c1
ChEBI Ontology
Outgoing
3-chlorobenzoate (
CHEBI:19984
)
has functional parent
benzoate (
CHEBI:16150
)
3-chlorobenzoate (
CHEBI:19984
)
is a
chlorobenzoate (
CHEBI:23133
)
3-chlorobenzoate (
CHEBI:19984
)
is conjugate base of
3-chlorobenzoic acid (
CHEBI:49410
)
Incoming
3-chlorobenzoic acid (
CHEBI:49410
)
is conjugate acid of
3-chlorobenzoate (
CHEBI:19984
)
IUPAC Name
3-chlorobenzoate
Synonyms
Sources
3-chlorobenzoic acid, ion(1−)
ChemIDplus
m
-chlorobenzoate
ChEBI
mCl-benzoate anion
NIST Chemistry WebBook
Manual Xref
Database
CPD-3486
MetaCyc
View more database links
Registry Numbers
Types
Sources
16887-60-8
CAS Registry Number
ChemIDplus
3663
Gmelin Registry Number
Gmelin
3904773
Beilstein Registry Number
Beilstein
Last Modified
24 February 2014