trichlorohydrin

Synonyms: "1,2,3-trichloropropane", "trichlorohydrin", "allyl trichloride", "glycerol trichlorohydrin", "glyceryl trichlorohydrin", "glyceroltrichlorohydrin", "1,3-trichloropropane", "glycerin trichlorohydrin".

Source: trichlorohydrin is a synthetic, chlorinated hydrocarbon used as an industrial solvent or cleaning/degreasing agent and is a contaminant in some pesticides.

Identifiers:

IUPAC Name: 1,2,3-trichloropropane
CAS Number: 96-18-4
PubChem ID: 7285
InChiKey: CFXQEHVMCRXUSD-UHFFFAOYSA-N
Canonical SMILES: C(C(CCl)Cl)Cl

Structural Properties:

Molecular Formula: C₃H₅Cl₃
Molecular Weight: 147.423

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 6

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

Johannsen, F.R., Levinskas, G.J., Rusch, G.M., Terrill, J.B. and Schroeder, R.E., 1988. Evaluation of the subchronic and reproductive effects of a series of chlorinated propanes in the rat. I. Toxicity of 1, 2, 3?trichloropropane. Journal of Toxicology and Environmental Health, Part A Current Issues, 25(3), pp.299-315. DOI: 10.1080/15287398809531211. URL: https://www.tandfonline.com/doi/abs/10.1080/15287398809531211.
National Toxicology Program, 1993. NTP Toxicology and Carcinogenesis of 1, 2, 3-Trichloropropane (CAS No. 96-18-4) in F344/N Rats and B6C3F1 Mice (Gavage Studies). National Toxicology Program technical report series, 384, p.1. URL: https://www.ncbi.nlm.nih.gov/pubmed/12692652.