ChemSpider 2D Image | 1,3-Thiazol-5-ylmethyl 3-(trifluoromethyl)-2-pyridinecarboxylate | C11H7F3N2O2S

1,3-Thiazol-5-ylmethyl 3-(trifluoromethyl)-2-pyridinecarboxylate

  • Molecular FormulaC11H7F3N2O2S
  • Average mass288.246 Da
  • Monoisotopic mass288.018036 Da
  • ChemSpider ID35234611

More details:

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

1,3-Thiazol-5-ylmethyl 3-(trifluoromethyl)-2-pyridinecarboxylate [ACD/IUPAC Name]
1,3-Thiazol-5-ylmethyl-3-(trifluormethyl)-2-pyridincarboxylat [German] [ACD/IUPAC Name]
2-Pyridinecarboxylic acid, 3-(trifluoromethyl)-, 5-thiazolylmethyl ester [ACD/Index Name]
3-(Trifluorométhyl)-2-pyridinecarboxylate de 1,3-thiazol-5-ylméthyle [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: 413.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.6±3.0 kJ/mol
Flash Point: 203.7±28.7 °C
Index of Refraction: 1.541
Molar Refractivity: 62.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.06
ACD/KOC (pH 5.5): 407.11
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.07
ACD/KOC (pH 7.4): 407.19
Polar Surface Area: 80 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 197.5±3.0 cm3

Click to predict properties on the Chemicalize site


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