2-Butoxy-3,5-dimethylphenylboronic acid

• CAS: 845551-41-9
• Catalog Number: ACM845551419
• Category: Other Products
• Molecular Weight: 222.09g/mol
• Molecular Formula: C12H19BO3
• IUPAC Name: (4-butoxy-3,5-dimethylphenyl)boronic acid
• Canonical SMILES: B(C1=CC(=C(C(=C1)C)OCCCC)C)(O)O
• InChI: InChI=1S/C12H19BO3/c1-4-5-6-16-12-9(2)7-11(13(14)15)8-10(12)3/h7-8,14-15H,4-6H2,1-3H3
• InChI Key: NOVHHUSAJRKJRC-UHFFFAOYSA-N
• Complexity: 187
• Covalently-Bonded Unit Count: 1
• Exact Mass: 222.142725g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 16
• Monoisotopic Mass: 222.142725g/mol
• Rotatable Bond Count: 5