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CAS Number: 71641-10-6
2-methylbenzofuran-4-carboxylic acid

Structure

 2-methylbenzofuran-4-carboxylic acid
Name: 2-methylbenzofuran-4-carboxylic acid
Synonyms:
General Information
Product Number: 71641106

CAS Registry Number 71641-10-6
Name:
4-?Benzofurancarboxylic acid, 2-?methyl-
2-Methylbenzofuran-4-carboxylic acid
Habropetaloic acid

 

Chemical Formula: C10H8O3
Exact Mass: 176.05
Molecular Weight: 176.17
m/z: 176.05 (100.0%), 177.05 (11.0%), 178.05 (1.2%)

 

InChI:InChI=1S/C10H8O3/c1-6-5-8-7(10(11)12)3-2-4-9(8)13-6/h2-5H,1H3,(H,11,12)

InChI Key:UULUUZLKDVRRQD-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(C=CC=C2O1)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 189-190 °C Solv: ethyl acetate (141-78-6) (1)CAS

Specification

98%
References
  1. (1) Huang, Zhiqiang; Journal of Agricultural and Food Chemistry 2011, V59(2), P635-644 CAPLUS
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