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CAS Number: 40740-57-6
5-fluorobenzo[b]thiophene-3-carboxylic acid

Structure

 5-fluorobenzo[b]thiophene-3-carboxylic acid
Name: 5-fluorobenzo[b]thiophene-3-carboxylic acid
Synonyms:
General Information
Product Number: 40740576

CAS Registry Number 40740-57-6
Name:
Benzo[b]?thiophene-?3-?carboxylic acid, 5-?fluoro-
5-Fluorobenzothiophene-3-carboxylic acid

 

Chemical Formula: C9H5FO2S
Exact Mass: 196.00
Molecular Weight: 196.20
m/z: 196.00 (100.0%), 197.00 (10.6%), 198.00 (5.0%)

 

InChI:InChI=1S/C9H5FO2S/c10-5-1-2-8-6(3-5)7(4-13-8)9(11)12/h1-4H,(H,11,12)

InChI Key:ZXOZGDMHUJRJRR-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1F)C(=CS2)C(=O)O

Specification

98%
References

PCT Int. Appl. (2002), WO 2002036583 A1 20020510.                                  

Journal of Medicinal Chemistry (2003), 46(12), 2446-2455. 
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