ChemSpider 2D Image | 5-Methyl-2-(~2~H_5_)phenyl-1,2-dihydro-3H-pyrazol-3-one | C10H5D5N2O

5-Methyl-2-(2H5)phenyl-1,2-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC10H5D5N2O
  • Average mass179.230 Da
  • Monoisotopic mass179.110703 Da
  • ChemSpider ID128943340

  • Non-standard isotope - Non-standard isotope

More details:

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

3H-Pyrazol-3-one, 1,2-dihydro-5-methyl-2-(phenyl-d5)- [ACD/Index Name]
5-Methyl-2-(2H5)phenyl-1,2-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
5-Methyl-2-(2H5)phenyl-1,2-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
5-Méthyl-2-(2H5)phényl-1,2-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
1228765-67-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 276.4±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.5±3.0 kJ/mol
Flash Point: 121.0±22.6 °C
Index of Refraction: 1.587
Molar Refractivity: 49.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 3.32
ACD/KOC (pH 5.5): 82.11
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 3.32
ACD/KOC (pH 7.4): 82.11
Polar Surface Area: 32 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 147.8±3.0 cm3

Click to predict properties on the Chemicalize site


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