ChemSpider 2D Image | 4-[2-Ethyl-7-(trifluoromethyl)-2H-indazol-3-yl]-1,3-benzenediol | C16H13F3N2O2

4-[2-Ethyl-7-(trifluoromethyl)-2H-indazol-3-yl]-1,3-benzenediol

  • Molecular FormulaC16H13F3N2O2
  • Average mass322.282 Da
  • Monoisotopic mass322.092926 Da
  • ChemSpider ID35033636

More details:

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

1,3-Benzenediol, 4-[2-ethyl-7-(trifluoromethyl)-2H-indazol-3-yl]- [ACD/Index Name]
4-[2-Ethyl-7-(trifluormethyl)-2H-indazol-3-yl]-1,3-benzoldiol [German] [ACD/IUPAC Name]
4-[2-Ethyl-7-(trifluoromethyl)-2H-indazol-3-yl]-1,3-benzenediol [ACD/IUPAC Name]
4-[2-Éthyl-7-(trifluorométhyl)-2H-indazol-3-yl]-1,3-benzènediol [French] [ACD/IUPAC Name]
4-[2-Ethyl-7-(Trifluoromethyl)-2h-Indazol-3-Yl]benzene-1,3-Diol
1429059-02-8 [RN]
1GM
4-(2-Ethyl-7-(trifluoromethyl)-2H-indazol-3-yl)benzene-1,3-diol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 511.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 263.1±28.7 °C
Index of Refraction: 1.594
Molar Refractivity: 77.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 155.43
ACD/KOC (pH 5.5): 1289.04
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 151.47
ACD/KOC (pH 7.4): 1256.23
Polar Surface Area: 58 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 42.2±7.0 dyne/cm
Molar Volume: 227.9±7.0 cm3

Click to predict properties on the Chemicalize site


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