AC1MX2FS structure

AC1MX2FS

5-[[4-(diethylamino)phenyl]methylidene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxopyridine-3-carbonitrile

Also Known As: 5-[[4-(diethylamino)phenyl]methylidene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxopyridine-3-carbonitrile

CAS: 877804-65-4
Molecular Formula C22H25N3O4S
Molecular Weight 427.1566 g/mol
LogP 2.31218
Topological Polar Surface Area 98.55 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 427.1566
Monoisotopic Mass 427.1566
Heavy Atoms 30
Complexity 1074.3745

Chemical Identifiers

CAS Number 877804-65-4
SMILES CCN(CC)C1=CC=C(C=C1)C=C2C(=C(C(=O)N(C2=O)C3CCS(=O)(=O)C3)C#N)C

Product Overview

AC1MX2FS (CAS 877804-65-4), with molecular formula C22H25N3O4S and molecular weight 427.1566 g/mol. IUPAC: 5-[[4-(diethylamino)phenyl]methylidene]-1-(1,1-dioxothiolan-3-yl)-4-methyl-2,6-dioxopyridine-3-carbonitrile.

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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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