4-chlorophenol

Synonyms: "p-chlorophenol", "parachlorophenol", "4-hydroxychlorobenzene", "4-monochlorophenol"

Source: 4-chlorophenol is a starting material for making 2-benzyl-4-chlorophenol, a germicide.

Identifiers:

IUPAC Name: 4-chlorophenol
CAS Number: 106-48-9
PubChem ID: 4684
InChiKey: WXNZTHHGJRFXKQ-UHFFFAOYSA-N
Canonical SMILES: C1=CC(=CC=C1O)Cl

Structural Properties:

Molecular Formula: C₆H₅ClO
Molecular Weight: 128.556

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 8

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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.