Molecule ID: 7393

IUPAC Name: 4-tert-butylphenol

Description: The molecule is a member of the class of phenols that is phenol substituted with a tert-butyl group at position 4. It has a role as an allergen.

SMILES: CC(C)(C)c1ccc(O)cc1

SELFIES: [C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]

InChI: InChI=1S/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 3.3