ChemSpider 2D Image | (S)-2-(Trifluoromethyl)piperazine | C5H9F3N2

(S)-2-(Trifluoromethyl)piperazine

  • Molecular FormulaC5H9F3N2
  • Average mass154.134 Da
  • Monoisotopic mass154.071777 Da
  • ChemSpider ID26235144

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(Trifluormethyl)piperazin [German] [ACD/IUPAC Name]
(2S)-2-(Trifluoromethyl)piperazine [ACD/IUPAC Name]
(2S)-2-(Trifluorométhyl)pipérazine [French] [ACD/IUPAC Name]
(S)-2-(Trifluoromethyl)piperazine
1187931-35-6 [RN]
Piperazine, 2-(trifluoromethyl)-, (2S)- [ACD/Index Name]
(2S)-2-(Trifluoromethyl)piperazine|(S)-2-(Trifluoromethyl)piperazine
(S)-2-Trifluoromethyl-piperazine
[1187931-35-6] [RN]
MFCD07373384 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 145.1±35.0 °C at 760 mmHg
    Vapour Pressure: 4.9±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 38.2±3.0 kJ/mol
    Flash Point: 41.5±25.9 °C
    Index of Refraction: 1.372
    Molar Refractivity: 29.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.30
    ACD/LogD (pH 5.5): -2.34
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.64
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 6.07
    Polar Surface Area: 24 Å2
    Polarizability: 11.9±0.5 10-24cm3
    Surface Tension: 20.2±3.0 dyne/cm
    Molar Volume: 131.6±3.0 cm3

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