4-(Diphenylamino)phenylboronic acid

• CAS: 201802-67-7
• Catalog Number: ACM201802677-4
• Category: Boro-Amino Acids
• Molecular Weight: 289.1
• Molecular Formula: C18H16BNO2
• Synonyms: 4-(N,N-Diphenylamino)-1-phenylboronicacid,4-(N,N-Diphenylamino)phenylboronicacid,4-(N-Diphenylamino)phenylboronicacid,4-(Diphenylamino)benzeneboronicacid,Triphenylamine-4-boronicacid
• IUPAC Name: [4-(N-phenylanilino)phenyl]boronicacid
• Canonical SMILES: B(C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3)(O)O
• InChI: InChI=1S/C18H16BNO2/c21-19(22)15-11-13-18(14-12-15)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14,21-22H
• InChI Key: TWWQCBRELPOMER-UHFFFAOYSA-N
• Boiling Point: 110 - 115 °C(lit.)
• Melting Point: 110-115 °C-lit.
• Complexity: 301
• Covalently-Bonded Unit Count: 1
• Exact Mass: 289.127409g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 22
• Monoisotopic Mass: 289.127409g/mol
• Rotatable Bond Count: 4