2-sec-pentylphenol

Synonyms: "o-sec-amylphenol", "2-(1-methylbutyl)phenol", "2-sec-amylphenol", "2-sec-pentylphenol", "2-(pentan-2-yl)phenol"

Source: 2-sec-pentylphenol is used as a stabilizer of cyclic alkene compositions for the semiconductor industry.

Identifiers:

IUPAC Name: 2-pentan-2-ylphenol
CAS Number: 26401-74-1
PubChem ID: 99016
InChiKey: ROMXEVFSCNLHAB-UHFFFAOYSA-N
Canonical SMILES: CCCC(C)C1=CC=CC=C1O

Structural Properties:

Molecular Formula: C11H16O
Molecular Weight: 164.244

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 12

Downloads

2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

Toxicological Information

Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors


Mueller GC, Kim UH. 1978. Displacement of estradiol from estrogen receptors by simple alkyl phenols. Endocrinology 102(5):1429-1435.

External Links

2D-structure

3D-structure