CAS Registry Number: 58235-80-6

Name:

2-​Furancarboxylic acid, 4-​bromo-​, methyl ester
4-​Bromofuran-​2-​carboxylic acid methyl ester 

Chemical Formula: C6H5BrO3
Exact Mass: 203.94
Molecular Weight: 205.01
m/z: 203.94 (100.0%), 205.94 (97.3%), 204.95 (6.7%), 206.94 (6.4%)
Elemental Analysis: C, 35.15; H, 2.46; Br, 38.98; O, 23.41

InChI: InChI=1S/C6H5BrO3/c1-9-6(8)5-2-4(7)3-10-5/h2-3H,1H3
InChIKey: RKEXKLRKXLRNMV-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC(=CO1)Br

Specification

98%

1. (1) Belen'kii, L. I.; Khimiya Geterotsiklicheskikh Soedinenii 1978, (3), P306-10 CAPLUS
2. (2) Belen'kii, L. I.; Khimiya Geterotsiklicheskikh Soedinenii 1975, (11), P1464-7 CAPLUS