AC1O1XJF structure

AC1O1XJF

(E)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-3-(4-methylphenyl)prop-2-enamide

Also Known As: (2E)-N-(3-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(4-methylphenyl)prop-2-enamide|(E)-N-(3-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)acrylamide|(E)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-3-(4-methylphenyl)prop-2-enamide

CAS: 620558-73-8
Molecular Formula C21H22ClNO3S
Molecular Weight 403.1009 g/mol
LogP 3.87752
Topological Polar Surface Area 54.45 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 5
Exact Mass 403.1009
Monoisotopic Mass 403.1009
Heavy Atoms 27
Complexity 951.647

Chemical Identifiers

CAS Number 620558-73-8
SMILES CC1=CC=C(C=C1)/C=C/C(=O)N(CC2=CC(=CC=C2)Cl)C3CCS(=O)(=O)C3

Product Overview

AC1O1XJF (CAS 620558-73-8), with molecular formula C21H22ClNO3S and molecular weight 403.1009 g/mol. IUPAC: (E)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-3-(4-methylphenyl)prop-2-enamide.

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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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