ChemSpider 2D Image | 4-Iodo-1-[6-(2-methyl-2-propanyl)-3-pyridinyl]-3-phenyl-1H-pyrazol-5-amine | C18H19IN4

4-Iodo-1-[6-(2-methyl-2-propanyl)-3-pyridinyl]-3-phenyl-1H-pyrazol-5-amine

  • Molecular FormulaC18H19IN4
  • Average mass418.275 Da
  • Monoisotopic mass418.065430 Da
  • ChemSpider ID118112999

More details:

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

1H-Pyrazol-5-amine, 1-[6-(1,1-dimethylethyl)-3-pyridinyl]-4-iodo-3-phenyl- [ACD/Index Name]
4-Iod-1-[6-(2-methyl-2-propanyl)-3-pyridinyl]-3-phenyl-1H-pyrazol-5-amin [German] [ACD/IUPAC Name]
4-Iodo-1-[6-(2-methyl-2-propanyl)-3-pyridinyl]-3-phenyl-1H-pyrazol-5-amine [ACD/IUPAC Name]
4-Iodo-1-[6-(2-méthyl-2-propanyl)-3-pyridinyl]-3-phényl-1H-pyrazol-5-amine [French] [ACD/IUPAC 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: 522.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 269.7±30.1 °C
Index of Refraction: 1.670
Molar Refractivity: 102.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1382.32
ACD/KOC (pH 5.5): 6153.29
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1388.28
ACD/KOC (pH 7.4): 6179.85
Polar Surface Area: 57 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 47.8±7.0 dyne/cm
Molar Volume: 274.2±7.0 cm3

Click to predict properties on the Chemicalize site


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