ChemSpider 2D Image | 3-Chloro-4H-pyrazole | C3H3ClN2

3-Chloro-4H-pyrazole

  • Molecular FormulaC3H3ClN2
  • Average mass102.522 Da
  • Monoisotopic mass101.998474 Da
  • ChemSpider ID68899321

More details:

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

3-Chlor-4H-pyrazol [German] [ACD/IUPAC Name]
3-Chloro-4H-pyrazole [ACD/IUPAC Name]
3-Chloro-4H-pyrazole [French] [ACD/IUPAC Name]
4H-Pyrazole, 3-chloro- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 140.3±23.0 °C at 760 mmHg
Vapour Pressure: 7.7±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.2±3.0 kJ/mol
Flash Point: 38.7±22.6 °C
Index of Refraction: 1.614
Molar Refractivity: 24.5±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.18
ACD/LogD (pH 5.5): -0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.11
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.47
ACD/KOC (pH 7.4): 64.94
Polar Surface Area: 25 Å2
Polarizability: 9.7±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 70.4±7.0 cm3

Click to predict properties on the Chemicalize site


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