trichloroethanol

Synonyms: "2,2,2-trichloroethanol", "trichloroethanol", "trichloroethyl alcohol", "trichlorethanol", "(hydroxymethyl)trichloromethane"

Source: trichloroethanol is the active metabolite of chloral hydrate, which is used as a sedative and hypnotic drug.

Identifiers:

IUPAC Name: 2,2,2-trichloroethanol
CAS Number: 115-20-8
PubChem ID: 8259
InChiKey: KPWDGTGXUYRARH-UHFFFAOYSA-N
Canonical SMILES: C(C(Cl)(Cl)Cl)O

Structural Properties:

Molecular Formula: C2H3Cl3O
Molecular Weight: 149,404

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 6

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Toxicological Information

ACToR (Aggregated Computational Toxicology Resource)

CCRIS (Chemical Carcinogenesis Research Information System)

GENE-TOX

CTD (Comparative Toxicogenomics Database)

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


Cosby NC, Dukelow WR. 1992. Toxicology of maternally ingested trichloroethylene (TCE) on embryonal and fetal development in mice and of TCE metabolites on in vitro fertilization. Fundam Appl Toxicol 19(2):268-274.

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