Found 2 results

Search term: JXHKUYQCEJILEI (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3,5-Diphenyl(1-~2~H)-1H-pyrazole | C15H11DN2

3,5-Diphenyl(1-2H)-1H-pyrazole

  • Molecular FormulaC15H11DN2
  • Average mass221.275 Da
  • Monoisotopic mass221.106323 Da
  • ChemSpider ID10499691
  • Non-standard isotope - Non-standard isotope


More details:






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

1H-Pyrazole-1-d, 3,5-diphenyl- [ACD/Index Name]
3,5-Diphenyl(1-2H)-1H-pyrazol [German] [ACD/IUPAC Name]
3,5-Diphenyl(1-2H)-1H-pyrazole [ACD/IUPAC Name]
3,5-Diphényl(1-2H)-1H-pyrazole [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 442.7±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 207.2±13.1 °C
Index of Refraction: 1.628
Molar Refractivity: 68.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1167.40
ACD/KOC (pH 5.5): 5458.33
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1167.90
ACD/KOC (pH 7.4): 5460.70
Polar Surface Area: 29 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 191.5±3.0 cm3

Click to predict properties on the Chemicalize site






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