ChemSpider 2D Image | 6-{[4-(Trifluoromethyl)-2-pyrimidinyl]oxy}-1H-indazole | C12H7F3N4O

6-{[4-(Trifluoromethyl)-2-pyrimidinyl]oxy}-1H-indazole

  • Molecular FormulaC12H7F3N4O
  • Average mass280.205 Da
  • Monoisotopic mass280.057190 Da
  • ChemSpider ID30119204

More details:

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

1H-Indazole, 6-[[4-(trifluoromethyl)-2-pyrimidinyl]oxy]- [ACD/Index Name]
6-{[4-(Trifluormethyl)-2-pyrimidinyl]oxy}-1H-indazol [German] [ACD/IUPAC Name]
6-{[4-(Trifluoromethyl)-2-pyrimidinyl]oxy}-1H-indazole [ACD/IUPAC Name]
6-{[4-(Trifluorométhyl)-2-pyrimidinyl]oxy}-1H-indazole [French] [ACD/IUPAC Name]
6-{[4-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]OXY}-1H-INDAZOLE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 458.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 231.0±31.5 °C
Index of Refraction: 1.608
Molar Refractivity: 64.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.78
ACD/KOC (pH 5.5): 315.77
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.78
ACD/KOC (pH 7.4): 315.77
Polar Surface Area: 64 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 185.6±3.0 cm3

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