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You are looking to 4-Isopropylphenol



General Information

Pubchem ID: 7465

IUPAC Name: 4-propan-2-ylphenol

Synonym/s: p-Cumenol, 4-(1-Methylethyl)phenol

Molecular Formula: C9H12O3

SMILES:


Known Interaction/s




Structural Values

Molecular Weight (Da): 136.1900

Number of Atoms: 22

Rotatable Bonds: 1

Molecular Refractivity (m³ • mol-1 ): 41.940



Physico-chemical Properties

Volume (cm³ • mol-1 ): 572.34

Solvent Accessible Surface Area (Ų): 364.61

Hydrogen Bond Donor: 1

Hydrogen Bond Acceptor: 1

Total Charge: 0

pKa: 10.12

AlogP: 2.75

Polar Surface Area (Å): 22.54



Pharmacological Analysis

Rule of Five or Lipinsky Rule: Satisfied

Rule of Three: Satisfied

Ghose Filter: Unsatisfied



Functional Group/s

Alkanol

Arene

Benzene

Phenol