You are looking to Benzene
General Information
Pubchem ID: 241
IUPAC Name: Benzene
Synonym/s: Cyclohexatriene, Cyclohexatriene
Molecular Formula: C6H6
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 78.1100
Number of Atoms: 12
Rotatable Bonds: 0
Molecular Refractivity (m³ • mol-1 ): 26.060
Physico-chemical Properties
Volume (cm³ • mol-1 ): 380.29
Solvent Accessible Surface Area (Ų): 266.00
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 0
Total Charge: 0
pKa: None
AlogP: 1.83
Polar Surface Area (Å): 0.00
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Satisfied
Ghose Filter: Unsatisfied
Functional Group/s
Arene
Benzene