ChemSpider 2D Image | 1-Methyl(~2~H)-1H-tetrazole | C2H3DN4

1-Methyl(2H)-1H-tetrazole

  • Molecular FormulaC2H3DN4
  • Average mass85.086 Da
  • Monoisotopic mass85.049873 Da
  • ChemSpider ID73959992

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Tetrazole-5-d, 1-methyl- [ACD/Index Name]
1-Methyl(2H)-1H-tetrazol [German] [ACD/IUPAC Name]
1-Methyl(2H)-1H-tetrazole [ACD/IUPAC Name]
1-Méthyl(2H)-1H-tétrazole [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: 171.3±23.0 °C at 760 mmHg
Vapour Pressure: 1.4±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.8±3.0 kJ/mol
Flash Point: 57.4±22.6 °C
Index of Refraction: 1.665
Molar Refractivity: 22.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.59
ACD/LogD (pH 5.5): -0.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.79
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.79
Polar Surface Area: 44 Å2
Polarizability: 8.8±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 59.6±7.0 cm3

Click to predict properties on the Chemicalize site


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