4-dodecylphenol

Synonyms: "p-dodecylphenol", "4-n-dodecylphenol"

Source: 4-dodecylphenol is used in surfactants, phenolic resins, and is a lube oil additive intermediate.

Identifiers:

IUPAC Name: 4-dodecylphenol
CAS Number: 104-43-8
PubChem ID: 66030
InChiKey: KJWMCPYEODZESQ-UHFFFAOYSA-N
Canonical SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)O

Structural Properties:

Molecular Formula: C₁₈H₃₀O
Molecular Weight: 262.430

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 19

Downloads

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

Search Similar molecules

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

Akahori Y, Nakai M, Yamasaki K, Takatsuki M, Shimohigashi Y, Ohtaki M. 2008. Relationship between the results of in vitro receptor binding assay to human estrogen receptor alpha and in vivo uterotrophic assay: Comparative study with 65 selected chemicals. Toxicol in Vitro 22(1):225-231.

Wetzel CH, Hermann B, Behl C, Pestel E, Rammes G, Zieglgansberger W, Holsboer F, Rupprecht R. 1998. Functional antagonism of gonadal steroids at the 5-hydroxytryptamine type 3 receptor. Mol Endocrinol 12(9):1441-1451.