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CAS Number: 38281-53-7
3-bromobenzofuran-2-carboxylic acid

Structure

3-bromobenzofuran-2-carboxylic acid
Name: 3-bromobenzofuran-2-carboxylic acid
Synonyms:
General Information
Product Number: 38281537

CAS Registry Number 38281-53-7
Name:
2-?Benzofurancarboxylic acid, 3-?bromo-
3-Bromo-2-carboxybenzofuran

 

Chemical Formula: C9H5BrO3
Exact Mass: 239.94
Molecular Weight: 241.04
m/z: 239.94 (100.0%), 241.94 (97.3%), 240.95 (9.9%), 242.94 (9.6%), 241.95 (1.1%)

 

InChI:InChI=1S/C9H5BrO3/c10-7-5-3-1-2-4-6(5)13-8(7)9(11)12/h1-4H,(H,11,12)

InChI Key:NACCIKKHVJKRQT-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C(=C(O2)C(=O)O)Br

 

Thermal Properties Value Condition Note
Melting Point 206-207 °C Solv: acetone (67-64-1); water (7732-18-5) (1)CAS

Specification

98%

References

(1) Ferraccioli, Raffaella; Journal of the American Chemical Society 2006, V128(3), P722-723 CAPLUS

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