ChemSpider 2D Image | N-Carbamoyl-N~3~-{[(2-methyl-2-propanyl)oxy]carbonyl}-beta-alaninamide | C9H17N3O4

N-Carbamoyl-N3-{[(2-methyl-2-propanyl)oxy]carbonyl}-β-alaninamide

  • Molecular FormulaC9H17N3O4
  • Average mass231.249 Da
  • Monoisotopic mass231.121902 Da
  • ChemSpider ID28545935

More details:

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

Carbamic acid, N-[3-[(aminocarbonyl)amino]-3-oxopropyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-Carbamoyl-N3-{[(2-methyl-2-propanyl)oxy]carbonyl}-β-alaninamid [German] [ACD/IUPAC Name]
N-Carbamoyl-N3-{[(2-methyl-2-propanyl)oxy]carbonyl}-β-alaninamide [ACD/IUPAC Name]
N-Carbamoyl-N3-{[(2-méthyl-2-propanyl)oxy]carbonyl}-β-alaninamide [French] [ACD/IUPAC Name]
220067-94-7 [RN]
MFCD20502014
tert-butyl N-[3-(carbamoylamino)-3-oxopropyl]carbamate

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.485
Molar Refractivity: 56.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.16
ACD/KOC (pH 5.5): 38.79
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.16
ACD/KOC (pH 7.4): 38.78
Polar Surface Area: 111 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 196.2±3.0 cm3

Click to predict properties on the Chemicalize site


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