ChemSpider 2D Image | 2-[1-(1,2-Thiazol-5-ylmethyl)-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethanol | C10H10F3N3OS

2-[1-(1,2-Thiazol-5-ylmethyl)-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethanol

  • Molecular FormulaC10H10F3N3OS
  • Average mass277.266 Da
  • Monoisotopic mass277.049652 Da
  • ChemSpider ID64945241

More details:

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

1H-Pyrazole-4-ethanol, 1-(5-isothiazolylmethyl)-3-(trifluoromethyl)- [ACD/Index Name]
2-[1-(1,2-Thiazol-5-ylmethyl)-3-(trifluormethyl)-1H-pyrazol-4-yl]ethanol [German] [ACD/IUPAC Name]
2-[1-(1,2-Thiazol-5-ylmethyl)-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethanol [ACD/IUPAC Name]
2-[1-(1,2-Thiazol-5-ylméthyl)-3-(trifluorométhyl)-1H-pyrazol-4-yl]éthanol [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 323.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.7±3.0 kJ/mol
Flash Point: 149.7±27.9 °C
Index of Refraction: 1.599
Molar Refractivity: 62.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.48
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 6.56
ACD/KOC (pH 5.5): 132.90
ACD/LogD (pH 7.4): 1.39
ACD/BCF (pH 7.4): 6.72
ACD/KOC (pH 7.4): 136.01
Polar Surface Area: 79 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 182.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement