ChemSpider 2D Image | 5-Chloro-3-(2,5-dimethyl-1H-pyrrol-1-yl)-1-methyl-1H-pyrazole | C10H12ClN3

5-Chloro-3-(2,5-dimethyl-1H-pyrrol-1-yl)-1-methyl-1H-pyrazole

  • Molecular FormulaC10H12ClN3
  • Average mass209.675 Da
  • Monoisotopic mass209.071976 Da
  • ChemSpider ID28697116

More details:

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

1H-Pyrazole, 5-chloro-3-(2,5-dimethyl-1H-pyrrol-1-yl)-1-methyl- [ACD/Index Name]
5-Chlor-3-(2,5-dimethyl-1H-pyrrol-1-yl)-1-methyl-1H-pyrazol [German] [ACD/IUPAC Name]
5-Chloro-3-(2,5-dimethyl-1H-pyrrol-1-yl)-1-methyl-1H-pyrazole [ACD/IUPAC Name]
5-Chloro-3-(2,5-diméthyl-1H-pyrrol-1-yl)-1-méthyl-1H-pyrazole [French] [ACD/IUPAC Name]
89088-52-8 [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: 338.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.9±3.0 kJ/mol
Flash Point: 158.7±27.9 °C
Index of Refraction: 1.607
Molar Refractivity: 58.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 2.93
ACD/BCF (pH 5.5): 99.14
ACD/KOC (pH 5.5): 934.40
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 99.14
ACD/KOC (pH 7.4): 934.40
Polar Surface Area: 23 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 39.6±7.0 dyne/cm
Molar Volume: 169.5±7.0 cm3

Click to predict properties on the Chemicalize site


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