ChemSpider 2D Image | 2-Methyl-2-propanyl 4-({1-[3-(trifluoromethyl)benzyl]-4-piperidinyl}carbamoyl)-1-piperidinecarboxylate | C24H34F3N3O3

2-Methyl-2-propanyl 4-({1-[3-(trifluoromethyl)benzyl]-4-piperidinyl}carbamoyl)-1-piperidinecarboxylate

  • Molecular FormulaC24H34F3N3O3
  • Average mass469.540 Da
  • Monoisotopic mass469.255219 Da
  • ChemSpider ID69768350

More details:

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

1-Piperidinecarboxylic acid, 4-[[[1-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]amino]carbonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-({1-[3-(trifluoromethyl)benzyl]-4-piperidinyl}carbamoyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-({1-[3-(trifluormethyl)benzyl]-4-piperidinyl}carbamoyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-({1-[3-(Trifluorométhyl)benzyl]-4-pipéridinyl}carbamoyl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 558.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 291.4±30.1 °C
Index of Refraction: 1.538
Molar Refractivity: 119.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 5.13
ACD/KOC (pH 5.5): 30.88
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 212.61
ACD/KOC (pH 7.4): 1280.15
Polar Surface Area: 62 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 45.0±5.0 dyne/cm
Molar Volume: 382.9±5.0 cm3

Click to predict properties on the Chemicalize site


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