ChemSpider 2D Image | 2-[5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N'-{(Z)-[2-nitro-6-(trifluoromethyl)phenyl]methylene}propanehydrazide | C16H13F6N5O3

2-[5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N'-{(Z)-[2-nitro-6-(trifluoromethyl)phenyl]methylene}propanehydrazide

  • Molecular FormulaC16H13F6N5O3
  • Average mass437.297 Da
  • Monoisotopic mass437.092255 Da
  • ChemSpider ID81834485
  • Double-bond stereo - Double-bond stereo


More details:






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

1H-Pyrazole-1-acetic acid, α,5-dimethyl-3-(trifluoromethyl)-, 2-[(1Z)-[2-nitro-6-(trifluoromethyl)phenyl]methylene]hydrazide [ACD/Index Name]
2-[5-Methyl-3-(trifluormethyl)-1H-pyrazol-1-yl]-N'-{(Z)-[2-nitro-6-(trifluormethyl)phenyl]methylen}propanhydrazid [German] [ACD/IUPAC Name]
2-[5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N'-{(Z)-[2-nitro-6-(trifluoromethyl)phenyl]methylene}propanehydrazide [ACD/IUPAC Name]
2-[5-Méthyl-3-(trifluorométhyl)-1H-pyrazol-1-yl]-N'-{(Z)-[2-nitro-6-(trifluorométhyl)phényl]méthylène}propanehydrazide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.545
Molar Refractivity: 90.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 889.71
ACD/KOC (pH 5.5): 4494.40
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 889.60
ACD/KOC (pH 7.4): 4493.88
Polar Surface Area: 105 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 40.3±7.0 dyne/cm
Molar Volume: 286.9±7.0 cm3

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