ChemSpider 2D Image | (3S)-3-Hydroxy-L-alpha-asparagine | C4H8N2O4

(3S)-3-Hydroxy-L-α-asparagine

  • Molecular FormulaC4H8N2O4
  • Average mass148.117 Da
  • Monoisotopic mass148.048401 Da
  • ChemSpider ID32980493

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S)-3-Hydroxy-L-α-asparagin [German] [ACD/IUPAC Name]
(3S)-3-Hydroxy-L-α-asparagine [ACD/IUPAC Name]
(3S)-3-Hydroxy-L-α-asparagine [French] [ACD/IUPAC Name]
1354422-64-2 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 530.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.6±6.0 kJ/mol
Flash Point: 274.4±30.1 °C
Index of Refraction: 1.582
Molar Refractivity: 30.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -3.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 127 Å2
Polarizability: 12.2±0.5 10-24cm3
Surface Tension: 96.0±3.0 dyne/cm
Molar Volume: 91.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement