ChemSpider 2D Image | N-Sulfamoyl-D-alanine | C3H8N2O4S

N-Sulfamoyl-D-alanine

  • Molecular FormulaC3H8N2O4S
  • Average mass168.172 Da
  • Monoisotopic mass168.020477 Da
  • ChemSpider ID50849160

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Alanine, N-(aminosulfonyl)- [ACD/Index Name]
N-Sulfamoyl-D-alanin [German] [ACD/IUPAC Name]
N-Sulfamoyl-D-alanine [ACD/IUPAC Name]
N-Sulfamoyl-D-alanine [French] [ACD/IUPAC Name]
1604384-05-5 [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: 401.1±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.6±6.0 kJ/mol
Flash Point: 196.4±29.3 °C
Index of Refraction: 1.544
Molar Refractivity: 33.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.48
ACD/LogD (pH 5.5): -3.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 72.4±3.0 dyne/cm
Molar Volume: 106.6±3.0 cm3

Click to predict properties on the Chemicalize site


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