4-n-butylphenol

Synonyms: "4-butylphenol", "p-hydroxybutylbenzene", "p-butylphenol", "1-hydroxy-4-n-butylbenzene"

Source: 4-n-butylphenol is used in organic synthesis as a reactant.

Identifiers:

IUPAC Name: 4-butylphenol
CAS Number: 1638-22-8
PubChem ID: 15420
InChiKey: CYYZDBDROVLTJU-UHFFFAOYSA-N
Canonical SMILES: CCCCC1=CC=C(C=C1)O

Structural Properties:

Molecular Formula: C₁₀H₁₄O
Molecular Weight: 150.218

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 11

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

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

Nishihara T, Nishikawa J, Kanayama T, Dakeyama F, Saito K, Imagawa M, Takatori S, Kitagawa Y, Hori S, Utsumi H. 2000. Estrogenic activities of 517 chemicals by yeast two-hybrid assay. Journal of Health Science 46(4):282-298.