3-Thienylboronic acid

• Catalog Number: ACM6165691
• Product Name: 3-Thienylboronic acid
• CAS: 6165-69-1
• Category: Thiophenes
• Synonyms: Thiophene-3-boronic acid
• IUPAC Name: thiophen-3-ylboronic acid
• Molecular Weight: 127.96g/mol
• Molecular Formula: C4H5BO2S
• Canonical SMILES: B(C1=CSC=C1)(O)O
• InChI: InChI=1S/C4H5BO2S/c6-5(7)4-1-2-8-3-4/h1-3,6-7H
• InChI Key: QNMBSXGYAQZCTN-UHFFFAOYSA-N
• Melting Point: 164-169 °C
• Appearance: Wihte or Off-White Solid
• Complexity: 78.4
• Covalently-Bonded Unit Count: 1
• Exact Mass: 128.010331g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 8
• Monoisotopic Mass: 128.010331g/mol
• Rotatable Bond Count: 1