fenarimol

Synonyms: "rimidin", "rubigan", "fenarimol"

Source: fenarimol is a widely used chlorinated fungicide applied to fruits and vegetables.

Identifiers:

IUPAC Name: (2-chlorophenyl)-(4-chlorophenyl)-pyrimidin-5-ylmethanol
CAS Number: 60168-88-9
PubChem ID: 43226
InChiKey: NHOWDZOIZKMVAI-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)(C3=CN=CN=C3)O)Cl

Structural Properties:

Molecular Formula: C₁₇H₁₂Cl₂N₂O
Molecular Weight: 331.196

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 22

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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

Kojima H, Katsura E, Takeuchi S, Niiyama K, Kobayashi K. 2004. Screening for estrogen and androgen receptor activities in 200 pesticides by in vitro reporter gene assays using Chinese hamster ovary cells. Environ Health Perspect 112(5):524-531.

Lemaire G, Mnif W, Pascussi JM, Pillon A, Rabenoelina F, Fenet H, Gomez E, Casellas C, Nicolas JC, Cavailles V, Duchesne MJ, Balaguer P. 2006. Identification of new human pregnane X receptor ligands among pesticides using a stable reporter cell system. Toxicol Sci 91(2):501-509.

Vinggaard AM, Breinholt V, Larsen JC. 1999. Screening of selected pesticides for oestrogen receptor activation in vitro. Food Additives & Contaminants 16(12):533-542.