ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]-1-piperidinecarboxylate | C12H20F3NO3

2-Methyl-2-propanyl 4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]-1-piperidinecarboxylate

  • Molecular FormulaC12H20F3NO3
  • Average mass283.287 Da
  • Monoisotopic mass283.139526 Da
  • ChemSpider ID32792951

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Piperidinecarboxylic acid, 4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[(1R)-2,2,2-trifluor-1-hydroxyethyl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[(1R)-2,2,2-Trifluoro-1-hydroxyéthyl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2227681-07-2 [RN]
MFCD31925665
tert-butyl 4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]piperidine-1-carboxylate
tert-butyl 4-[(1R)-2,2,2-trifluoro-1-hydroxy-ethyl]piperidine-1-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 332.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.7±6.0 kJ/mol
Flash Point: 154.9±26.5 °C
Index of Refraction: 1.448
Molar Refractivity: 62.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.31
ACD/KOC (pH 5.5): 289.74
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.31
ACD/KOC (pH 7.4): 289.73
Polar Surface Area: 50 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 234.2±3.0 cm3

Click to predict properties on the Chemicalize site


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