4-Bromo-2-thiophenecarboxylic Acid , >98.0%(GC)(T) , 16694-18-1

CAS NO.：16694-18-1

Empirical Formula: C5H3BrO2S

Molecular Weight: 207.05

MDL number: MFCD03422294

EINECS: 679-544-1

PRODUCT Properties

• Melting point: 121 °C
• Boiling point: 323.7±27.0 °C(Predicted)
• Density: 1.923±0.06 g/cm3(Predicted)
• storage temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• form: powder to crystal
• pka: 3.50±0.10(Predicted)
• color: White to Light yellow
• λmax: 245nm(EtOH)(lit.)
• InChI: InChI=1S/C5H3BrO2S/c6-3-1-4(5(7)8)9-2-3/h1-2H,(H,7,8)
• InChIKey: HJZFPRVFLBBAMU-UHFFFAOYSA-N
• SMILES: C1(C(O)=O)SC=C(Br)C=1
• CAS DataBase Reference: 16694-18-1(CAS DataBase Reference)

Description and Uses

4-Bromo-2-thiophenecarboxylic Acid, can be used as an intermediate for the synthesis of N-(4-Bromo-2-thienyl)-carbamic Acid 1,1-Dimethylethyl Ester (B688120). The studies also shown that it can also have potency to act as a novel d-Amino Acid Oxidase (DAO)Inhibitors.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319
• Precautionary statements: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
• Hazard Codes: Xi,Xn
• Risk Statements: 20/21/22-36/37/38
• Safety Statements: 22-26-36/37/39-37/39
• HazardClass: IRRITANT
• HS Code: 29349990