ChemSpider 2D Image | 5-[(5-Fluoro-3-methyl-1H-indazol-4-yl)oxy]isophthalonitrile | C16H9FN4O

5-[(5-Fluoro-3-methyl-1H-indazol-4-yl)oxy]isophthalonitrile

  • Molecular FormulaC16H9FN4O
  • Average mass292.267 Da
  • Monoisotopic mass292.076050 Da
  • ChemSpider ID23334493

More details:

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

1,3-Benzenedicarbonitrile, 5-[(5-fluoro-3-methyl-1H-indazol-4-yl)oxy]- [ACD/Index Name]
5-[(5-Fluor-3-methyl-1H-indazol-4-yl)oxy]isophthalonitril [German] [ACD/IUPAC Name]
5-[(5-fluoro-3-methyl-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile
5-[(5-Fluoro-3-méthyl-1H-indazol-4-yl)oxy]isophtalonitrile [French] [ACD/IUPAC Name]
5-[(5-Fluoro-3-methyl-1H-indazol-4-yl)oxy]isophthalonitrile [ACD/IUPAC Name]
1,3-Benzenedicarbonitrile,5-[(5-fluoro-3-methyl-1H-indazol-4-yl)oxy]-
1123741-50-3 [RN]
5-((5-fluoro-3-methyl-1H-indazol-4-yl)oxy)isophthalonitrile
5-(5-fluoro-3-methyl-1H-indazol-4-yloxy)isophthalonitrile
5-[(5-FLUORO-3-METHYL-1H-INDAZOL-4-YL)OXY]-1,3-BENZENEDICARBONITRILE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 457.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 230.6±28.7 °C
Index of Refraction: 1.678
Molar Refractivity: 76.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 170.07
ACD/KOC (pH 5.5): 1374.97
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 170.07
ACD/KOC (pH 7.4): 1374.97
Polar Surface Area: 85 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 77.2±5.0 dyne/cm
Molar Volume: 202.6±5.0 cm3

Click to predict properties on the Chemicalize site


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