2-Fluoro-6-proproxyphenylboronic acid

• Catalog Number: ACM870777187-1
• Product Name: 2-Fluoro-6-proproxyphenylboronic acid
• CAS: 870777-18-7
• Category: Boronic Acids
• IUPAC Name: (2-fluoro-6-propoxyphenyl)boronic acid
• Molecular Weight: 198g/mol
• Molecular Formula: C9H12BFO3
• Canonical SMILES: B(C1=C(C=CC=C1F)OCCC)(O)O
• InChI: InChI=1S/C9H12BFO3/c1-2-6-14-8-5-3-4-7(11)9(8)10(12)13/h3-5,12-13H,2,6H2,1H3
• InChI Key: MRVRMZWHFZYTCY-UHFFFAOYSA-N
• Complexity: 168
• Covalently-Bonded Unit Count: 1
• Exact Mass: 198.086353g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 14
• Monoisotopic Mass: 198.086353g/mol
• Rotatable Bond Count: 4