4-(1,1,3,4-Tetramethylpentyl)phenol

HCID 4454822

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Basic information

Standard SMILES: CC(C)C(C)CC(C)(C)c1ccc(O)cc1
InChIKey: XEZVCVLCUIUUBX-UHFFFAOYSA-N
Molecular formula: C15H24O
Average molar mass: 220.35 g/mol
Monoisotopic mass: 220.18271539

Names & identifiers

Preferred name: 4-(1,1,3,4-Tetramethylpentyl)phenol
IUPAC: 4-(2,4,5-trimethylhexan-2-yl)phenol

Names & synonyms

4-(1,1,3,4-tetramethylpentyl)phenolSCHEMBL13061691XEZVCVLCUIUUBX-UHFFFAOYSA-NDTXSID701339605SBB060748AKOS024390880Phenol, 4-(1,1,3,4-tetramethylpentyl)ST51046868

Database identifiers

PubChem CID: 4454822
DTXSID: DTXSID701339605
Nikkaji: J2.875.306C

Properties

Computed structural properties

XLogP: 5.4
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 4
Heavy atoms: 16
Formal charge: 0
Complexity: 199

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