ChemSpider 2D Image | 2-(~2~H_5_)Phenyl-1,3-propanediyl dicarbamate | C11H9D5N2O4

2-(2H5)Phenyl-1,3-propanediyl dicarbamate

  • Molecular FormulaC11H9D5N2O4
  • Average mass243.271 Da
  • Monoisotopic mass243.126740 Da
  • ChemSpider ID110404834

  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Propanediol, 2-(phenyl-d5)-, dicarbamate [ACD/Index Name]
2-(2H5)Phenyl-1,3-propandiyldicarbamat [German] [ACD/IUPAC Name]
2-(2H5)Phenyl-1,3-propanediyl dicarbamate [ACD/IUPAC Name]
Dicarbamate de 2-(2H5)phényl-1,3-propanediyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 511.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 288.4±26.4 °C
Index of Refraction: 1.559
Molar Refractivity: 60.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.64
ACD/KOC (pH 5.5): 87.71
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.64
ACD/KOC (pH 7.4): 87.71
Polar Surface Area: 105 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 186.8±3.0 cm3

Click to predict properties on the Chemicalize site


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