ChemSpider 2D Image | 1-[(2,6-~2~H_2_)Phenyl]-1H-pyrazole | C9H6D2N2

1-[(2,6-2H2)Phenyl]-1H-pyrazole

  • Molecular FormulaC9H6D2N2
  • Average mass146.186 Da
  • Monoisotopic mass146.081299 Da
  • ChemSpider ID74798258

  • Non-standard isotope - Non-standard isotope

More details:

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

1-[(2,6-2H2)Phenyl]-1H-pyrazol [German] [ACD/IUPAC Name]
1-[(2,6-2H2)Phenyl]-1H-pyrazole [ACD/IUPAC Name]
1-[(2,6-2H2)Phényl]-1H-pyrazole [French] [ACD/IUPAC Name]
1H-Pyrazole, 1-(phenyl-2,6-d2)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 250.7±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.8±3.0 kJ/mol
Flash Point: 96.5±18.7 °C
Index of Refraction: 1.592
Molar Refractivity: 45.9±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.01
ACD/KOC (pH 5.5): 275.60
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 18.01
ACD/KOC (pH 7.4): 275.61
Polar Surface Area: 18 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 42.2±7.0 dyne/cm
Molar Volume: 135.8±7.0 cm3

Click to predict properties on the Chemicalize site


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