CLORETHATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H4Cl6O3
Molecular Weight	324.801
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

ClC(Cl)(Cl)COC(=O)OCC(Cl)(Cl)Cl

InChI

InChIKey=IEPBPSSCIZTJIF-UHFFFAOYSA-N

InChI=1S/C5H4Cl6O3/c6-4(7,8)1-13-3(12)14-2-5(9,10)11/h1-2H2

HIDE SMILES / InChI

Molecular Formula	C5H4Cl6O3
Molecular Weight	324.801
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/6034844 | https://patents.google.com/patent/US3193573A/en

Clorethate is a hypnotic sedative drug, discovered by SmithKline in the 1960s. In mice, oral administration the drug leads to depression of spontaneous motor activity with ED50 of 288 mg/kg.

Approval Year

PubMed

Title	Date	PubMed
Trichloroethyl carbonate. I. Synthesis, physical properties, and pharmacology.	1967 Jul	6034844

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:12:51 GMT 2023` Edited by `admin` on `Fri Dec 15 16:12:51 GMT 2023`
Record UNII	9VY0HXB11T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CLORETHATE

Official Name

English

CLORETHATE [USAN]

Common Name

English

ETHANOL, 2,2,2-TRICHLORO-, CARBONATE

Systematic Name

English

CHLORETHATE

Common Name

English

NSC-15887

Code

English

cloretate [INN]

Common Name

English

Bis(2,2,2-trichloroethyl)carbonate

Systematic Name

English

SK&F 12866

Code

English

SK&F-12866

Code

English

CLORETATE

Official Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29756