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CAS Number: 442125-04-4
6-chlorobenzofuran-2-carboxylic acid

Structure

6-chlorobenzofuran-2-carboxylic acid
Name: 6-chlorobenzofuran-2-carboxylic acid
Synonyms:
General Information
Product Number: 442125044

CAS Registry Number 442125-04-4
Name:
2-​Benzofurancarboxylic acid, 6-​chloro-
6-Chloro-1-benzofuran-2-carboxylic acid

 

Chemical Formula: C9H5ClO3
Exact Mass: 195.99
Molecular Weight: 196.59
m/z: 195.99 (100.0%), 197.99 (32.0%), 197.00 (9.9%), 198.99 (3.1%), 198.00 (1.1%)

 

InChI:InChI=1S/C9H5ClO3/c10-6-2-1-5-3-8(9(11)12)13-7(5)4-6/h1-4H,(H,11,12)

InChI Key:PWSOSTMTCRJPDX-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Cl)OC(=C2)C(=O)O

Specification

98%

References
  1. (1) Yoshikawa, Kenji; Bioorganic & Medicinal Chemistry 2009, V17(24), P8206-8220 CAPLUS
  2. (2) Gensini, Martina; ChemMedChem 2010, V5(1), P65-78 CAPLUS
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