ChemSpider 2D Image | tert-butyl N-{[3-(trifluoromethyl)pyridin-2-yl]methyl}carbamate | C12H15F3N2O2

tert-butyl N-{[3-(trifluoromethyl)pyridin-2-yl]methyl}carbamate

  • Molecular FormulaC12H15F3N2O2
  • Average mass276.255 Da
  • Monoisotopic mass276.108551 Da
  • ChemSpider ID110415605

More details:

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

{[3-(Trifluorométhyl)-2-pyridinyl]méthyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1396734-59-0 [RN]
2-Methyl-2-propanyl {[3-(trifluoromethyl)-2-pyridinyl]methyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{[3-(trifluormethyl)-2-pyridinyl]methyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[[3-(trifluoromethyl)-2-pyridinyl]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl N-{[3-(trifluoromethyl)pyridin-2-yl]methyl}carbamate
tert-Butyl ((3-(trifluoromethyl)pyridin-2-yl)methyl)carbamate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 328.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.0±3.0 kJ/mol
Flash Point: 152.2±27.9 °C
Index of Refraction: 1.464
Molar Refractivity: 62.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 40.30
ACD/KOC (pH 5.5): 490.41
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 40.32
ACD/KOC (pH 7.4): 490.68
Polar Surface Area: 51 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 32.3±3.0 dyne/cm
Molar Volume: 227.4±3.0 cm3

Click to predict properties on the Chemicalize site


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