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CAS Number: 81245-24-1
methyl 2-methoxy-4-methylbenzoate

Structure

methyl 2-methoxy-4-methylbenzoate
Name: methyl 2-methoxy-4-methylbenzoate
Synonyms:
General Information
Product Number: 81245241
CAS Registry Number:
81245-24-1
Name:
Benzoic acid, 2-​methoxy-​4-​methyl-​, methyl ester
o-​Anisic acid, 4-​methyl-​, methyl ester (6CI,​7CI); 2-​Methoxy-​4-​methylbenzoic acid methyl ester; Methyl 2-​methoxy-​4-​methylbenzoate; Methyl 4-​methyl-​2-​methoxybenzoate; Methyl o-​methoxy-​p-​toluate 
 
Chemical Formula: C10H12O3
Exact Mass: 180.08
Molecular Weight: 180.20
m/z: 180.08 (100.0%), 181.08 (11.1%)
Elemental Analysis: C, 66.65; H, 6.71; O, 26.64
 
InChI: InChI=1S/C10H12O3/c1-7-4-5-8(10(11)13-3)9(6-7)12-2/h4-6H,1-3H3
InChIKey: LHNVKRSDQCCHEK-UHFFFAOYSA-N
Canonical SMILES : CC1=CC(=C(C=C1)C(=O)OC)OC
 
Thermal Properties Value Condition Note
Boiling Point 263-265 °C   (1)CAS
Boiling Point 142 °C Press: 22 Torr (2)CAS
Melting Point 29 °C   (2)CAS

Specification

98%

References
  1. (1) Perkin, William Henry, Jr.; Journal of the Chemical Society, Transactions 1906, V89, P1649-65 CAPLUS
  2. (2) Julia, Marc; Bulletin de la Societe Chimique de France 1962, P2255-61 CAPLUS
  3. (3) Gensini, Martina; ChemMedChem 2010, V5(1), P65-78 CAPLUS
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