ChemSpider 2D Image | 4-Iodo-5-methyl-3H-pyrazole | C4H5IN2

4-Iodo-5-methyl-3H-pyrazole

  • Molecular FormulaC4H5IN2
  • Average mass208.000 Da
  • Monoisotopic mass207.949738 Da
  • ChemSpider ID111988989

More details:

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

3H-Pyrazole, 4-iodo-5-methyl- [ACD/Index Name]
4-Iod-5-methyl-3H-pyrazol [German] [ACD/IUPAC Name]
4-Iodo-5-methyl-3H-pyrazole [ACD/IUPAC Name]
4-Iodo-5-méthyl-3H-pyrazole [French] [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 182.0±40.0 °C at 760 mmHg
Vapour Pressure: 1.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.1±3.0 kJ/mol
Flash Point: 63.9±27.3 °C
Index of Refraction: 1.716
Molar Refractivity: 37.0±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 11.89
ACD/KOC (pH 5.5): 204.74
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 11.89
ACD/KOC (pH 7.4): 204.74
Polar Surface Area: 25 Å2
Polarizability: 14.7±0.5 10-24cm3
Surface Tension: 48.8±7.0 dyne/cm
Molar Volume: 94.1±7.0 cm3

Click to predict properties on the Chemicalize site


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