ChemSpider 2D Image | N-[2-(1-Azepanyl)-2-(4-methylphenyl)ethyl]-2-ethylbutanamide | C21H34N2O

N-[2-(1-Azepanyl)-2-(4-methylphenyl)ethyl]-2-ethylbutanamide

  • Molecular FormulaC21H34N2O
  • Average mass330.508 Da
  • Monoisotopic mass330.267120 Da
  • ChemSpider ID21611463

More details:

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

Butanamide, 2-ethyl-N-[2-(hexahydro-1H-azepin-1-yl)-2-(4-methylphenyl)ethyl]- [ACD/Index Name]
N-[2-(1-Azepanyl)-2-(4-methylphenyl)ethyl]-2-ethylbutanamid [German] [ACD/IUPAC Name]
N-[2-(1-Azepanyl)-2-(4-methylphenyl)ethyl]-2-ethylbutanamide [ACD/IUPAC Name]
N-[2-(1-Azépanyl)-2-(4-méthylphényl)éthyl]-2-éthylbutanamide [French] [ACD/IUPAC Name]
N-[2-(Azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-ethylbutanamide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 497.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.5±3.0 kJ/mol
Flash Point: 254.6±27.3 °C
Index of Refraction: 1.521
Molar Refractivity: 101.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.84
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 40.48
ACD/KOC (pH 7.4): 295.87
Polar Surface Area: 32 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 332.4±3.0 cm3

Click to predict properties on the Chemicalize site


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