You are looking to 1-Heptanol
General Information
Pubchem ID: 8129
IUPAC Name: Heptan-1-ol
Synonym/s: Heptyl alcohol, ---
Molecular Formula: C7H16O
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 116.2000
Number of Atoms: 24
Rotatable Bonds: 5
Molecular Refractivity (m³ • mol-1 ): 35.930
Physico-chemical Properties
Volume (cm³ • mol-1 ): 581.10
Solvent Accessible Surface Area (Ų): 378.31
Hydrogen Bond Donor: 1
Hydrogen Bond Acceptor: 1
Total Charge: 0
pKa: None
AlogP: 2.34
Polar Surface Area (Å): 22.40
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Unsatisfied
Functional Group/s
Alkanol