You are looking to Anisole
General Information
Pubchem ID: 7519
IUPAC Name: Anisole
Synonym/s: Methoxybenzene, Methyl phenyl ether
Molecular Formula: C7H8O
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 108.1400
Number of Atoms: 16
Rotatable Bonds: 1
Molecular Refractivity (m³ • mol-1 ): 32.520
Physico-chemical Properties
Volume (cm³ • mol-1 ): 455.38
Solvent Accessible Surface Area (Ų): 302.51
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 1
Total Charge: 0
pKa: None
AlogP: 1.81
Polar Surface Area (Å): 8.28
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Satisfied
Ghose Filter: Unsatisfied
Functional Group/s
Ether
Arene
Benzene