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Structure

4-Cyano-3-methylbenzoic acid methyl ester

CAS
25978-68-1
Catalog Number
ACM25978681
Category
Other Products
Molecular Weight
175.183960 [g/mol]
Molecular Formula
C10H9NO2

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Specification

Synonyms
4-Cyano-3-methylbenzoic acid methyl ester;Methyl 4-cyano-3-methylbenzoate
IUPAC Name
methyl 4-cyano-3-methylbenzoate
Canonical SMILES
CC1=C(C=CC(=C1)C(=O)OC)C#N
InChI Key
LIXWSMOADOOTOR-UHFFFAOYSA-N
Boiling Point
311.8ºC at 760 mmHg
Flash Point
145.2ºC
Density
1.15
Exact Mass
175.06300
H-Bond Acceptor
3
H-Bond Donor
0
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