3-Isopropoxy-2,4,6-trifluorophenylboronic acid

• CAS: 871125-73-4
• Catalog Number: ACM871125734-1
• Category: Boronic Acids
• Molecular Weight: 233.98g/mol
• Molecular Formula: C9H10BF3O3
• IUPAC Name: (2,4,6-trifluoro-3-propan-2-yloxyphenyl)boronic acid
• Canonical SMILES: B(C1=C(C(=C(C=C1F)F)OC(C)C)F)(O)O
• InChI: InChI=1S/C9H10BF3O3/c1-4(2)16-9-6(12)3-5(11)7(8(9)13)10(14)15/h3-4,14-15H,1-2H3
• InChI Key: ROCZYUISNXPFSX-UHFFFAOYSA-N
• Complexity: 230
• Covalently-Bonded Unit Count: 1
• Exact Mass: 234.067509g/mol
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 2
• Heavy Atom Count: 16
• Monoisotopic Mass: 234.067509g/mol
• Rotatable Bond Count: 3