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CAS Number: 501892-99-5
3-methylbenzofuran-5-carboxylic acid

Structure

3-methylbenzofuran-5-carboxylic acid
Name: 3-methylbenzofuran-5-carboxylic acid
Synonyms:
General Information
Product Number: 501892995

CAS Registry Number 501892-99-5
Name:
5-​Benzofurancarboxylic acid, 3-​methyl-
3-Methyl-1-benzofuran-5-carboxylic acid
3-Methylbenzofuran-5-carboxylic 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/c1-6-5-13-9-3-2-7(10(11)12)4-8(6)9/h2-5H,1H3,(H,11,12)

InChI Key:ICGCSXAZTJXZAG-UHFFFAOYSA-N

Canonical SMILES:CC1=COC2=C1C=C(C=C2)C(=O)O

Specification

98%

References

PCT Int. Appl. (2012), WO 2012149157 A2 20121101.

PCT Int. Appl. (2011), WO 2011073316 A1 20110623.

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