ChemSpider 2D Image | N-Carbamoyl-D-threonine | C5H10N2O4

N-Carbamoyl-D-threonine

  • Molecular FormulaC5H10N2O4
  • Average mass162.144 Da
  • Monoisotopic mass162.064056 Da
  • ChemSpider ID110457477

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

D-Threonine, N-(aminocarbonyl)- [ACD/Index Name]
N-Carbamoyl-D-threonin [German] [ACD/IUPAC Name]
N-Carbamoyl-D-threonine [ACD/IUPAC Name]
N-Carbamoyl-D-thréonine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 382.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 73.0±6.0 kJ/mol
Flash Point: 185.1±27.9 °C
Index of Refraction: 1.536
Molar Refractivity: 35.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.78
ACD/LogD (pH 5.5): -3.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 113.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement