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CHEBI:166854 - 5-chloro-2-methylbenzoic acid
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ChEBI Name
5-chloro-2-methylbenzoic acid
ChEBI ID
CHEBI:166854
Definition
A member of the class of chlorobenzoic acids that is benzoic acid in which the ring hydrogens at positions 2 and 5 are replaced by methyl and chloro groups, respectively.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Elad Noor
Supplier Information
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Molfile
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Molfile
Formula
C8H7ClO2
Net Charge
0
Average Mass
170.590
Monoisotopic Mass
170.01346
InChI
InChI=1S/C8H7ClO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4H,1H3,(H,10,11)
InChIKey
CSAPESWNZDOAFU-UHFFFAOYSA-N
SMILES
CC1=CC=C(Cl)C=C1C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
5-chloro-2-methylbenzoic acid (
CHEBI:166854
)
is a
chlorobenzoic acid (
CHEBI:23134
)
5-chloro-2-methylbenzoic acid (
CHEBI:166854
)
is a
monochlorobenzenes (
CHEBI:83403
)
5-chloro-2-methylbenzoic acid (
CHEBI:166854
)
is a
toluenes (
CHEBI:27024
)
IUPAC Name
5-chloro-2-methylbenzoic acid
Synonyms
Sources
2-methyl-5-chlorobenzoic acid
SUBMITTER
5-chloro-2-methyl-benzoic acid
ChEBI
5-chloro-
o
-toluic acid
ChemIDplus
benzoic acid, 5-chloro-2-methyl-
ChemIDplus
Manual Xref
Database
74014
ChemSpider
View more database links
Registry Numbers
Types
Sources
2249814
Reaxys Registry Number
Reaxys
7499-06-1
CAS Registry Number
ChemIDplus
Last Modified
16 November 2020