4-Biphenylboronic acid

• Catalog Number: ACM5122941
• Product Name: 4-Biphenylboronic acid
• CAS: 5122-94-1
• Category: Boronic Acids
• Synonyms: Biphenyl-4-boronic acid
• IUPAC Name: (4-phenylphenyl)boronic acid
• Molecular Weight: 198.03
• Molecular Formula: C12H11BO2
• Canonical SMILES: B(C1=CC=C(C=C1)C2=CC=CC=C2)(O)O
• InChI: InChI=1S/C12H11BO2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,14-15H
• InChI Key: XPEIJWZLPWNNOK-UHFFFAOYSA-N
• Boiling Point: 385.5±35.0 °C
• Melting Point: 232-245 °C (lit.)
• Density: 1.18±0.1 g/ml
• Complexity: 182
• Covalently-Bonded Unit Count: 1
• Exact Mass: 198.08521g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 15
• Monoisotopic Mass: 198.08521g/mol
• Rotatable Bond Count: 2