CAS Registry Number: 5198-88-9
Name:

2-Bromo-4-thiazolecarboxylic acid

2-bromo-1,3-thiazole-4-carboxylic Acid

Chemical Formula: C4H2BrNO2S
Exact Mass: 206.90
Molecular Weight: 208.03
m/z: 206.90 (100.0%), 208.90 (97.7%), 207.90 (5.6%), 209.90 (5.3%), 208.89 (4.5%), 210.89 (4.4%)

InChI
InChI=1S/C4H2BrNO2S/c5-4-6-2(1-9-4)3(7)8/h1H,(H,7,8)
InChI Key
BEGREHRAUWCAHV-UHFFFAOYSA-N
Canonical SMILES
C1=C(N=C(S1)Br)C(=O)O

Specification

98%

Organic Process Research & Development (2017), 21(10), 1602-1609

Journal of Medicinal Chemistry (2017), 60(14), 6166-6190