ChemSpider 2D Image | N~3~-[4-(Diethylamino)benzyl]-N-ethyl-beta-alaninamide | C16H27N3O

N3-[4-(Diethylamino)benzyl]-N-ethyl-β-alaninamide

  • Molecular FormulaC16H27N3O
  • Average mass277.405 Da
  • Monoisotopic mass277.215424 Da
  • ChemSpider ID21329677

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1040693-73-9 [RN]
3-({[4-(diethylamino)phenyl]methyl}amino)-N-ethylpropanamide
N3-[4-(Diethylamino)benzyl]-N-ethyl-β-alaninamid [German] [ACD/IUPAC Name]
N3-[4-(Diethylamino)benzyl]-N-ethyl-β-alaninamide [ACD/IUPAC Name]
N3-[4-(Diéthylamino)benzyl]-N-éthyl-β-alaninamide [French] [ACD/IUPAC Name]
Propanamide, 3-[[[4-(diethylamino)phenyl]methyl]amino]-N-ethyl- [ACD/Index Name]
3-((4-(diethylamino)benzyl)amino)-N-ethylpropanamide
3-[[4-(diethylamino)phenyl]methylamino]-N-ethylpropanamide
3-{[4-(Diethylamino)benzyl]amino}-N-ethylpropanamide
N3-[4-(diethylamino)benzyl]-N1-ethyl-b-alaninamide

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD10687393 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 468.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.1±3.0 kJ/mol
Flash Point: 237.3±24.6 °C
Index of Refraction: 1.534
Molar Refractivity: 85.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): -1.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.27
Polar Surface Area: 44 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 274.0±3.0 cm3

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