3-(4'-Fluorobenzyloxy)phenylboronic acid

• CAS: 1072952-03-4
• Catalog Number: ACM1072952034
• Category: Other Products
• Molecular Weight: 246.04g/mol
• Molecular Formula: C13H12BFO3
• Synonyms: 3-(4-Fluorobenzyloxy)phenylboronic acid, 1072952-03-4, SureCN459524, 666777_ALDRICH, CTK8E9232, AKOS009318759, AK-84896, BP-11436, KB-27075, X1573, (3-((4-Fluorobenzyl)oxy)phenyl)boronic acid, 3-(4 inverted exclamation marka-Fluorobenzyloxy)phenylboronic acid
• IUPAC Name: [3-[(4-fluorophenyl)methoxy]phenyl]boronic acid
• Canonical SMILES: B(C1=CC(=CC=C1)OCC2=CC=C(C=C2)F)(O)O
• InChI: InChI=1S/C13H12BFO3/c15-12-6-4-10(5-7-12)9-18-13-3-1-2-11(8-13)14(16)17/h1-8,16-17H,9H2
• InChI Key: WSTWPQWJAKLITI-UHFFFAOYSA-N
• Complexity: 244
• Covalently-Bonded Unit Count: 1
• Exact Mass: 246.086353g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 18
• Monoisotopic Mass: 246.086353g/mol
• Rotatable Bond Count: 4