ChemSpider 2D Image | N-Allyl-N~2~-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-alaninamide | C11H20N2O3

N-Allyl-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-alaninamide

  • Molecular FormulaC11H20N2O3
  • Average mass228.288 Da
  • Monoisotopic mass228.147400 Da
  • ChemSpider ID24737441

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Carbamic acid, N-[(1S)-1-methyl-2-oxo-2-(2-propen-1-ylamino)ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-Allyl-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-alaninamid [German] [ACD/IUPAC Name]
N-Allyl-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-alaninamide [ACD/IUPAC Name]
N-Allyl-N2-{[(2-méthyl-2-propanyl)oxy]carbonyl}-L-alaninamide [French] [ACD/IUPAC Name]
891194-92-6 [RN]
tert-butyl N-[(1S)-1-[(prop-2-en-1-yl)carbamoyl]ethyl]carbamate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 388.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 188.8±25.9 °C
Index of Refraction: 1.463
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.23
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.90
ACD/KOC (pH 5.5): 92.15
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 3.90
ACD/KOC (pH 7.4): 92.13
Polar Surface Area: 67 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 223.9±3.0 cm3

Click to predict properties on the Chemicalize site


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