Agn-PC-036E1D structure

Agn-PC-036E1D

4-(dimethylamino)-3-(propan-2-ylamino)but-3-en-2-one

Also Known As: AGN-PC-036E1D|4-(dimethylamino)-3-(propan-2-ylamino)but-3-en-2-one|4-(dimethylamino)-3-[(propan-2-yl)amino]but-3-en-2-one|3-Buten-2-one, 4-(dimethylamino)-3-[(1-methylethyl)amino]-

CAS: 49582-65-2
Molecular Formula C9H18N2O
Molecular Weight 170.1419 g/mol
LogP 1.3
Topological Polar Surface Area 32.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 170.1419
Monoisotopic Mass 170.1419
Heavy Atoms 12
Complexity 183.0

Chemical Identifiers

CAS Number 49582-65-2
SMILES CC(C)NC(=CN(C)C)C(=O)C
InChIKey VGIQYZPCUPONAG-UHFFFAOYSA-N

Product Overview

Agn-PC-036E1D (CAS 49582-65-2), with molecular formula C9H18N2O and molecular weight 170.1419 g/mol. IUPAC: 4-(dimethylamino)-3-(propan-2-ylamino)but-3-en-2-one.

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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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