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ChEBI
> Main
CHEBI:86903 - methyl
p
-anisate
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ChEBI Ontology
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ChEBI Name
methyl
p
-anisate
ChEBI ID
CHEBI:86903
ChEBI ASCII Name
methyl p-anisate
Definition
A benzoate ester obtained by the formal condensation of the carboxy group of 4-methoxybenzoic acid with methanol.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C9H10O3
Net Charge
0
Average Mass
166.17390
Monoisotopic Mass
166.06299
InChI
InChI=1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3
InChIKey
DDIZAANNODHTRB-UHFFFAOYSA-N
SMILES
COC(=O)c1ccc(OC)cc1
ChEBI Ontology
Outgoing
methyl
p
-anisate (
CHEBI:86903
)
has functional parent
4-methoxybenzoic acid (
CHEBI:40813
)
methyl
p
-anisate (
CHEBI:86903
)
is a
benzoate ester (
CHEBI:36054
)
methyl
p
-anisate (
CHEBI:86903
)
is a
monomethoxybenzene (
CHEBI:25235
)
IUPAC Name
methyl 4-methoxybenzoate
Synonyms
Sources
4-methoxy methylbenzoate
NIST Chemistry WebBook
Methyl 4-anisate
ChemIDplus
methyl 4-anisate
ChEBI
p-Methoxybenzoic acid methyl ester
NIST Chemistry WebBook
Registry Numbers
Types
Sources
121-98-2
CAS Registry Number
NIST Chemistry WebBook
121-98-2
CAS Registry Number
ChemIDplus
2208571
Reaxys Registry Number
Reaxys
Last Modified
06 September 2021