ChemSpider 2D Image | 3-Chloro-3-methyl-3H-pyrazole | C4H5ClN2

3-Chloro-3-methyl-3H-pyrazole

  • Molecular FormulaC4H5ClN2
  • Average mass116.549 Da
  • Monoisotopic mass116.014130 Da
  • ChemSpider ID28685160

More details:

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

3-Chlor-3-methyl-3H-pyrazol [German] [ACD/IUPAC Name]
3-Chloro-3-methyl-3H-pyrazole [ACD/IUPAC Name]
3-Chloro-3-méthyl-3H-pyrazole [French] [ACD/IUPAC Name]
3H-Pyrazole, 3-chloro-3-methyl- [ACD/Index Name]
141097-03-2 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 138.4±40.0 °C at 760 mmHg
Vapour Pressure: 8.4±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.0±3.0 kJ/mol
Flash Point: 37.5±27.3 °C
Index of Refraction: 1.560
Molar Refractivity: 29.5±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.04
ACD/LogD (pH 5.5): 0.78
ACD/BCF (pH 5.5): 2.30
ACD/KOC (pH 5.5): 63.24
ACD/LogD (pH 7.4): 0.78
ACD/BCF (pH 7.4): 2.30
ACD/KOC (pH 7.4): 63.24
Polar Surface Area: 25 Å2
Polarizability: 11.7±0.5 10-24cm3
Surface Tension: 40.3±7.0 dyne/cm
Molar Volume: 91.1±7.0 cm3

Click to predict properties on the Chemicalize site


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