ChemSpider 2D Image | N-{(2S)-3-Ethyl-1-oxo-1-[(2,4,4-trimethyl-2-pentanyl)amino]-2-pentanyl}-N-(2-methyl-2-propanyl)hexanamide | C25H50N2O2

N-{(2S)-3-Ethyl-1-oxo-1-[(2,4,4-trimethyl-2-pentanyl)amino]-2-pentanyl}-N-(2-methyl-2-propanyl)hexanamide

  • Molecular FormulaC25H50N2O2
  • Average mass410.677 Da
  • Monoisotopic mass410.387238 Da
  • ChemSpider ID62646219

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Hexanamide, N-(1,1-dimethylethyl)-N-[(1S)-2-ethyl-1-[[(1,1,3,3-tetramethylbutyl)amino]carbonyl]butyl]- [ACD/Index Name]
N-{(2S)-3-Ethyl-1-oxo-1-[(2,4,4-trimethyl-2-pentanyl)amino]-2-pentanyl}-N-(2-methyl-2-propanyl)hexanamid [German] [ACD/IUPAC Name]
N-{(2S)-3-Ethyl-1-oxo-1-[(2,4,4-trimethyl-2-pentanyl)amino]-2-pentanyl}-N-(2-methyl-2-propanyl)hexanamide [ACD/IUPAC Name]
N-{(2S)-3-Éthyl-1-oxo-1-[(2,4,4-triméthyl-2-pentanyl)amino]-2-pentanyl}-N-(2-méthyl-2-propanyl)hexanamide [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 523.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.8±3.0 kJ/mol
Flash Point: 270.6±25.4 °C
Index of Refraction: 1.465
Molar Refractivity: 125.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 6.76
ACD/LogD (pH 5.5): 6.65
ACD/BCF (pH 5.5): 67030.36
ACD/KOC (pH 5.5): 99134.73
ACD/LogD (pH 7.4): 6.65
ACD/BCF (pH 7.4): 67030.43
ACD/KOC (pH 7.4): 99134.84
Polar Surface Area: 49 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 31.4±3.0 dyne/cm
Molar Volume: 452.4±3.0 cm3

Click to predict properties on the Chemicalize site


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