ChemSpider 2D Image | 1-(4-Fluorobenzyl)-N-[4-(trifluoromethyl)benzyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide | C22H19F4N3O2

1-(4-Fluorobenzyl)-N-[4-(trifluoromethyl)benzyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide

  • Molecular FormulaC22H19F4N3O2
  • Average mass433.399 Da
  • Monoisotopic mass433.141327 Da
  • ChemSpider ID67882445

More details:

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

1-(4-Fluorbenzyl)-N-[4-(trifluormethyl)benzyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-(4-Fluorobenzyl)-N-[4-(trifluoromethyl)benzyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide [ACD/IUPAC Name]
1-(4-Fluorobenzyl)-N-[4-(trifluorométhyl)benzyl]-1,4,6,7-tétrahydropyrano[4,3-c]pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
Pyrano[4,3-c]pyrazole-3-carboxamide, 1-[(4-fluorophenyl)methyl]-1,4,6,7-tetrahydro-N-[[4-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
1-(4-fluorobenzyl)-N3-[4-(trifluoromethyl)benzyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 582.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 106.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 476.55
ACD/KOC (pH 5.5): 2874.70
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 476.55
ACD/KOC (pH 7.4): 2874.70
Polar Surface Area: 56 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 42.2±7.0 dyne/cm
Molar Volume: 313.4±7.0 cm3

Click to predict properties on the Chemicalize site


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