4-ETHOXY-3-FORMYLPHENYLBORONIC ACID

• Catalog Number: ACM480424633
• Product Name: 4-ETHOXY-3-FORMYLPHENYLBORONIC ACID
• CAS: 480424-63-3
• Category: Heterocyclic Organic Compound
• IUPAC Name: (4-ethoxy-3-formylphenyl)boronic acid
• Molecular Weight: 193.99g/mol
• Molecular Formula: C9H11BO4
• Canonical SMILES: B(C1=CC(=C(C=C1)OCC)C=O)(O)O
• InChI: InChI=1S/C9H11BO4/c1-2-14-9-4-3-8(10(12)13)5-7(9)6-11/h3-6,12-13H,2H2,1H3
• InChI Key: ODRRAKCLFURNFU-UHFFFAOYSA-N
• Complexity: 186
• Covalently-Bonded Unit Count: 1
• Exact Mass: 194.075039g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 14
• Monoisotopic Mass: 194.075039g/mol
• Rotatable Bond Count: 4