3-Fluoro-2-thiophenecarboxylic Acid

• Catalog: OFC32431848-2
• CAS: 32431-84-8
• Category: Fluorinated Thiophenes
• Synonyms: 2-Thiophenecarboxylic acid, 3-fluoro-
• Purity: >98.0%(GC)(T)
• MDL Number: MFCD03426911

• IUPAC Name: 3-fluorothiophene-2-carboxylic acid
• InChI: InChI=1S/C5H3FO2S/c6-3-1-2-9-4(3)5(7)8/h1-2H,(H,7,8)
• InChI Key: WPHRBUAOSDHRDS-UHFFFAOYSA-N
• Isomeric SMILES: C1=CSC(=C1F)C(=O)O
• EC Number: 805-834-6

• Molecular Formula: C5H3FO2S
• Molecular Weight: 146.14
• Melting Point: 175.0-179.0 °C
• Appearance: White to almost white powder to crystal
• Storage: 0-10 °C
• Stability: Heat sensitive

• XLogP3-AA: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 145.98377867 g/mol
• Monoisotopic Mass: 145.98377867 g/mol
• Topological Polar Surface Area: 65.5Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 128

• HS Number: 2934.99.4400