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CAS Number: 10242-09-8
5-methylbenzofuran-2-carboxylic acid

Structure

5-methylbenzofuran-2-carboxylic acid
Name: 5-methylbenzofuran-2-carboxylic acid
Synonyms:
General Information
Product Number: 10242098

CAS Registry Number 10242-09-8
Name:
2-​Benzofurancarboxylic acid, 5-​methyl-
Coumarilic acid, 5-methyl- (6CI)
5-Methyl-1-benzofuran-2-carboxylic acid
5-Methyl-2-benzofurancarboxylic 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/c1-6-2-3-8-7(4-6)5-9(13-8)10(11)12/h2-5H,1H3,(H,11,12)

InChI Key:RNTYTQILDXWFLQ-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(C=C1)OC(=C2)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 238-240 °C Solv: ethanol (64-17-5) (4)CAS
Melting Point 237-238 °C Solv: acetone (67-64-1) (2)IC
Melting Point 192-193 °C   (3)CAS

Specification

98%

References
  1. (2) Suzuki, Tsuneo; Bulletin of the Chemical Society of Japan 1983, V56(9), P2762-7 CAPLUS
  2. (3) Lee, Jaekyoo; Synthetic Communications 2010, V40(22), P3390-3396 CAPLUS
  3. (4) Greenhalgh, Colin William; GB 890305 1962 CAPLUS
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