ChemSpider 2D Image | 2-({[4-(4-Fluorophenyl)-2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl}amino)ethanol | C13H12F4N2OS

2-({[4-(4-Fluorophenyl)-2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl}amino)ethanol

  • Molecular FormulaC13H12F4N2OS
  • Average mass320.306 Da
  • Monoisotopic mass320.060638 Da
  • ChemSpider ID44905570

More details:

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

2-({[4-(4-Fluorophenyl)-2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl}amino)ethanol [ACD/IUPAC Name]
2-({[4-(4-Fluorophényl)-2-(trifluorométhyl)-1,3-thiazol-5-yl]méthyl}amino)éthanol [French] [ACD/IUPAC Name]
2-({[4-(4-Fluorphenyl)-2-(trifluormethyl)-1,3-thiazol-5-yl]methyl}amino)ethanol [German] [ACD/IUPAC Name]
Ethanol, 2-[[[4-(4-fluorophenyl)-2-(trifluoromethyl)-5-thiazolyl]methyl]amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 403.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 197.6±28.7 °C
Index of Refraction: 1.533
Molar Refractivity: 71.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 1.13
ACD/KOC (pH 5.5): 15.36
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 20.84
ACD/KOC (pH 7.4): 284.32
Polar Surface Area: 73 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 230.8±3.0 cm3

Click to predict properties on the Chemicalize site


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