ChemSpider 2D Image | Benzyl 5-(trifluoromethyl)spiro[indoline-3,4'-piperidine]-1'-carboxylate | C21H21F3N2O2

Benzyl 5-(trifluoromethyl)spiro[indoline-3,4'-piperidine]-1'-carboxylate

  • Molecular FormulaC21H21F3N2O2
  • Average mass390.399 Da
  • Monoisotopic mass390.155518 Da
  • ChemSpider ID24599326

More details:

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

1243328-71-3 [RN]
5-(Trifluorométhyl)-1,2-dihydro-1'H-spiro[indole-3,4'-piperidine]-1'-carboxylate de benzyle [French] [ACD/IUPAC Name]
Benzyl 5-(trifluoromethyl)-1,2-dihydro-1'H-spiro[indole-3,4'-piperidine]-1'-carboxylate [ACD/IUPAC Name]
Benzyl 5-(trifluoromethyl)spiro[indoline-3,4'-piperidine]-1'-carboxylate
Benzyl-5-(trifluormethyl)-1,2-dihydro-1'H-spiro[indole-3,4'-piperidine]-1'-carboxylat [German] [ACD/IUPAC Name]
Spiro[3H-indole-3,4'-piperidine]-1'-carboxylic acid, 1,2-dihydro-5-(trifluoromethyl)-, phenylmethyl ester [ACD/Index Name]
AJ-111774
AK-38860
AKOS022177499
AM803073
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 485.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.1±3.0 kJ/mol
    Flash Point: 247.3±28.7 °C
    Index of Refraction: 1.593
    Molar Refractivity: 98.8±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.41
    ACD/LogD (pH 5.5): 4.55
    ACD/BCF (pH 5.5): 1698.86
    ACD/KOC (pH 5.5): 7136.17
    ACD/LogD (pH 7.4): 4.55
    ACD/BCF (pH 7.4): 1702.66
    ACD/KOC (pH 7.4): 7152.12
    Polar Surface Area: 42 Å2
    Polarizability: 39.2±0.5 10-24cm3
    Surface Tension: 50.1±5.0 dyne/cm
    Molar Volume: 291.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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