You are looking to 4-Octanal
General Information
Pubchem ID: 11515
IUPAC Name: Octan-4-ol
Synonym/s: 4-Octyl Alcohol, Butylpropylcarbinol
Molecular Formula: C8H18O
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 130.2300
Number of Atoms: 27
Rotatable Bonds: 5
Molecular Refractivity (m³ • mol-1 ): 40.270
Physico-chemical Properties
Volume (cm³ • mol-1 ): 636.49
Solvent Accessible Surface Area (Ų): 406.38
Hydrogen Bond Donor: 1
Hydrogen Bond Acceptor: 1
Total Charge: 0
pKa: None
AlogP: 2.78
Polar Surface Area (Å): 20.37
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Unsatisfied
Functional Group/s
Alkanol