ChemSpider 2D Image | 1-(4-Aminophenyl)-5-chloro-1H-pyrazole-4-carbonitrile | C10H7ClN4

1-(4-Aminophenyl)-5-chloro-1H-pyrazole-4-carbonitrile

  • Molecular FormulaC10H7ClN4
  • Average mass218.642 Da
  • Monoisotopic mass218.035919 Da
  • ChemSpider ID24746034

More details:

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

1-(4-Aminophenyl)-5-chlor-1H-pyrazol-4-carbonitril [German] [ACD/IUPAC Name]
1-(4-Aminophenyl)-5-chloro-1H-pyrazole-4-carbonitrile [ACD/IUPAC Name]
1-(4-Aminophényl)-5-chloro-1H-pyrazole-4-carbonitrile [French] [ACD/IUPAC Name]
1H-Pyrazole-4-carbonitrile, 1-(4-aminophenyl)-5-chloro- [ACD/Index Name]
1269291-73-7 [RN]
MFCD17168516

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

CCRIS 4693 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 434.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.6±25.9 °C
Index of Refraction: 1.686
Molar Refractivity: 59.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.62
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 12.06
ACD/KOC (pH 5.5): 206.82
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 12.07
ACD/KOC (pH 7.4): 207.02
Polar Surface Area: 68 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 58.2±7.0 dyne/cm
Molar Volume: 154.9±7.0 cm3

Click to predict properties on the Chemicalize site


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