ChemSpider 2D Image | 5-Isopropylamino-2-Phenyl-6-(1h-1,2,4-Triazol-5-Yl)-3(2h)-Pyridazinone | C15H16N6O

5-Isopropylamino-2-Phenyl-6-(1h-1,2,4-Triazol-5-Yl)-3(2h)-Pyridazinone

  • Molecular FormulaC15H16N6O
  • Average mass296.327 Da
  • Monoisotopic mass296.138550 Da
  • ChemSpider ID31136036

More details:

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

3(2H)-Pyridazinone, 5-[(1-methylethyl)amino]-2-phenyl-6-(1H-1,2,4-triazol-3-yl)- [ACD/Index Name]
5-(Isopropylamino)-2-phenyl-6-(1H-1,2,4-triazol-3-yl)-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
5-(Isopropylamino)-2-phenyl-6-(1H-1,2,4-triazol-3-yl)-3(2H)-pyridazinone [ACD/IUPAC Name]
5-(Isopropylamino)-2-phényl-6-(1H-1,2,4-triazol-3-yl)-3(2H)-pyridazinone [French] [ACD/IUPAC Name]
5-Isopropylamino-2-Phenyl-6-(1h-1,2,4-Triazol-5-Yl)-3(2h)-Pyridazinone
WF8

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

Density: 1.4±0.1 g/cm3
Boiling Point: 552.2±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 287.8±30.9 °C
Index of Refraction: 1.693
Molar Refractivity: 83.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 2.68
ACD/KOC (pH 5.5): 70.53
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.58
ACD/KOC (pH 7.4): 67.70
Polar Surface Area: 86 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 54.2±7.0 dyne/cm
Molar Volume: 218.4±7.0 cm3

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