Butyranilide, 2',4'-dichloro-3-(diethylamino)-

HCID 58008

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Basic information

CAS: 100794-93-2
Standard SMILES: CCN(CC)C(C)CC(=O)Nc1ccc(Cl)cc1Cl
InChIKey: WWWSCOXEFNEXKF-UHFFFAOYSA-N
Molecular formula: C14H20Cl2N2O
Average molar mass: 303.2 g/mol
Monoisotopic mass: 302.0952687

Names & identifiers

Preferred name: Butyranilide, 2',4'-dichloro-3-(diethylamino)-
IUPAC: N-(2,4-dichlorophenyl)-3-(diethylamino)butanamide

Names & synonyms

100794-93-2BUTYRANILIDE, 2',4'-DICHLORO-3-(DIETHYLAMINO)-RefChem:1080440BRN 33492262',4'-Dichloro-3-(diethylamino)butyranilideButanamide,N-(2,4-dichlorophenyl)-3-(diethylamino)-4-12-00-01249 (Beilstein Handbook Reference)DTXSID60905744Butanamide, N-(2,4-dichlorophenyl)-3-(diethylamino)-N-(2,4-Dichlorophenyl)-3-(diethylamino)butanimidic acid

Database identifiers

CAS: 100794-93-2
PubChem CID: 58008
DTXSID: DTXSID60905744

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 6
Heavy atoms: 19
Formal charge: 0
Complexity: 285

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