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CAS Number: 17266-30-7
2-(5-chlorobenzo[b]thiophen-3-yl)acetic acid

Structure

 2-(5-chlorobenzo[b]thiophen-3-yl)acetic acid
Name: 2-(5-chlorobenzo[b]thiophen-3-yl)acetic acid
Synonyms:
General Information
Product Number: 17266307

CAS Registry Number 17266-30-7
Name:
Benzo[b]?thiophene-?3-?acetic acid, 5-?chloro-
(5-Chlorobenzo[b]thiophen-3-yl)acetic acid
2-(5-Chlorobenzo[b]thiophen-3-yl)acetic acid
3-(5-Chlorobenzo[b]thienyl)acetic acid
5-Chlorobenzo[b]thien-3-ylacetic acid
5-Chlorobenzo[b]thiophene-3-acetic acid

 

Chemical Formula: C10H7ClO2S
Exact Mass: 225.99
Molecular Weight: 226.68
m/z: 225.99 (100.0%), 227.98 (36.5%), 226.99 (11.0%), 228.99 (3.6%), 229.98 (1.5%), 227.99 (1.0%)

 

InChI:InChI=1S/C10H7ClO2S/c11-7-1-2-9-8(4-7)6(5-14-9)3-10(12)13/h1-2,4-5H,3H2,(H,12,13)

InChI Key:QQKKTOPRRGBBCT-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Cl)C(=CS2)CC(=O)O

Specification

98%
References
  1. (1) Jahnke, Wolfgang; Nature Chemical Biology 2010, V6(9), P660-666 CAPLUS
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