AC1MHFJ3 structure

AC1MHFJ3

S-ethyl 3-(1-phenylethyl)imidazole-4-carbothioate;hydrochloride

Also Known As: 5-Methylthio-2,4,2',4'-tetrachlorobiphenyl|4-Imidazolethiocarboxylic acid, 3-(alpha-methylbenzyl)-, S-ethyl ester, hydrochloride, (+)-|4-Imidazolethiocarboxylic acid, 3-(alpha-methylbenzyl)-, S-ethyl ester, hydrochloride, (+-)-|(+)-S-Ethyl, 3-(alpha-methylbenzyl)-4-imidazolethiocarboxylate hydrochloride|(+-)-S-Ethyl, 3-(alpha-methylbenzyl)-4-imidazolethiocarboxylate hydrochloride|(-)-S-Ethyl, 3-(alpha-methylbenzyl)-4-imidazolethiocarboxylate hydrochloride|4-Imidazolethiocarboxylic acid, 3-(alpha-methylbenzyl)-, S-ethyl ester, hydrochloride, (-)-|S-ethyl 3-(1-phenylethyl)imidazole-4-carbothioate hydrochloride|S-ethyl 3-(1-phenylethyl)imidazole-4-carbothioate,hydrochloride|1H-Imidazole-5-carbothioic acid, 1-(1-phenylethyl)-, S-ethyl ester, monohydrochloride, ()-|S-Ethyl 1-(1-phenylethyl)-1H-imidazole-5-carbothioate--hydrogen chloride (1/1)|1H-Imidazole-5-carbothioic acid, 1-(1-phenylethyl)-, S-ethyl ester, monohydrochloride, (-)-|1H-Imidazole-5-carbothioic acid, 1-(1-phenylethyl)-, S-ethyl ester, monohydrochloride, (.+.)-

CAS: 66641-84-7
Molecular Formula C14H17ClN2OS
Molecular Weight 296.075 g/mol
LogP 3.8075
Topological Polar Surface Area 34.89 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 296.075
Monoisotopic Mass 296.075
Heavy Atoms 19
Complexity 527.2521

Chemical Identifiers

CAS Number 66641-84-7
SMILES CCSC(=O)C1=CN=CN1C(C)C2=CC=CC=C2.Cl

Product Overview

AC1MHFJ3 (CAS 66641-84-7), with molecular formula C14H17ClN2OS and molecular weight 296.075 g/mol. IUPAC: S-ethyl 3-(1-phenylethyl)imidazole-4-carbothioate;hydrochloride.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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