5-Acetyl-2-thienylboronic acid

• CAS: 206551-43-1
• Catalog Number: ACM206551431
• Category: Thiophenes
• Molecular Weight: 170g/mol
• Molecular Formula: C6H7BO3S
• Synonyms: 5-Acetyl-2-thiopheneboronic acid
• IUPAC Name: (5-acetylthiophen-2-yl)boronic acid
• Canonical SMILES: B(C1=CC=C(S1)C(=O)C)(O)O
• InChI: InChI=1S/C6H7BO3S/c1-4(8)5-2-3-6(11-5)7(9)10/h2-3,9-10H,1H3
• InChI Key: DCNMATSPQKWETQ-UHFFFAOYSA-N
• Appearance: Solid
• Complexity: 162
• Covalently-Bonded Unit Count: 1
• Exact Mass: 170.020895g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 11
• Monoisotopic Mass: 170.020895g/mol
• Rotatable Bond Count: 2