2,6-Difluoro-3-propoxyphenylboronic acid

• Catalog Number: ACM849062142
• Product Name: 2,6-Difluoro-3-propoxyphenylboronic acid
• CAS: 849062-14-2
• Category: Boronic Acids
• IUPAC Name: (2,6-difluoro-3-propoxyphenyl)boronic acid
• Molecular Weight: 215.99g/mol
• Molecular Formula: C9H11BF2O3
• Canonical SMILES: B(C1=C(C=CC(=C1F)OCCC)F)(O)O
• InChI: InChI=1S/C9H11BF2O3/c1-2-5-15-7-4-3-6(11)8(9(7)12)10(13)14/h3-4,13-14H,2,5H2,1H3
• InChI Key: AGDROYNYQZNERV-UHFFFAOYSA-N
• Complexity: 194
• Covalently-Bonded Unit Count: 1
• Exact Mass: 216.076931g/mol
• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 2
• Heavy Atom Count: 15
• Monoisotopic Mass: 216.076931g/mol
• Rotatable Bond Count: 4