ChemSpider 2D Image | 3-Amino-N~2~-(methoxycarbonyl)alaninamide | C5H11N3O3

3-Amino-N2-(methoxycarbonyl)alaninamide

  • Molecular FormulaC5H11N3O3
  • Average mass161.159 Da
  • Monoisotopic mass161.080048 Da
  • ChemSpider ID28563486

More details:

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

3-Amino-N2-(methoxycarbonyl)alaninamid [German] [ACD/IUPAC Name]
3-Amino-N2-(methoxycarbonyl)alaninamide [ACD/IUPAC Name]
3-Amino-N2-(méthoxycarbonyl)alaninamide [French] [ACD/IUPAC Name]
Carbamic acid, N-[2-amino-1-(aminomethyl)-2-oxoethyl]-, methyl ester [ACD/Index Name]
494227-53-1 [RN]
CARBAMIC ACID, [2-AMINO-1-(AMINOMETHYL)-2-OXOETHYL]-, METHYL ESTER
Methyl (1,3-diamino-1-oxopropan-2-yl)carbamate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 389.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 189.5±26.5 °C
Index of Refraction: 1.499
Molar Refractivity: 37.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.33
ACD/LogD (pH 5.5): -4.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 128.2±3.0 cm3

Click to predict properties on the Chemicalize site


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