Butylbenzaldehyde

• CAS: 1200-14-2
• Catalog Number: ACM1200142
• Category: Other Products
• Molecular Weight: 162.23g/mol
• Molecular Formula: C11H14O
• IUPAC Name: 4-butylbenzaldehyde
• Canonical SMILES: CCCCC1=CC=C(C=C1)C=O
• InChI: InChI=1S/C11H14O/c1-2-3-4-10-5-7-11(9-12)8-6-10/h5-9H,2-4H2,1H3
• InChI Key: ARIREUPIXAKDAY-UHFFFAOYSA-N
• Complexity: 123
• Covalently-Bonded Unit Count: 1
• EC Number: 214-851-2
• Exact Mass: 162.104465g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 12
• Monoisotopic Mass: 162.104465g/mol
• Rotatable Bond Count: 4
• XLogP3: 3.2