ChemSpider 2D Image | 3-(2-Ethylhexyl)pyrrolidine | C12H25N

3-(2-Ethylhexyl)pyrrolidine

  • Molecular FormulaC12H25N
  • Average mass183.334 Da
  • Monoisotopic mass183.198700 Da
  • ChemSpider ID25076635

More details:

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

1220019-23-7 [RN]
3-(2-Ethylhexyl)pyrrolidin [German] [ACD/IUPAC Name]
3-(2-Ethylhexyl)pyrrolidine [ACD/IUPAC Name]
3-(2-Éthylhexyl)pyrrolidine [French] [ACD/IUPAC Name]
Pyrrolidine, 3-(2-ethylhexyl)- [ACD/Index Name]
3-(2-ETHYLHEXYL)PYRROLIDINE|3-(2-ETHYLHEXYL)PYRROLIDINE
MFCD13562880 [MDL number]

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

    Density: 0.8±0.1 g/cm3
    Boiling Point: 232.6±8.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 46.9±3.0 kJ/mol
    Flash Point: 91.1±16.5 °C
    Index of Refraction: 1.444
    Molar Refractivity: 58.9±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.39
    ACD/LogD (pH 5.5): 1.00
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.23
    ACD/LogD (pH 7.4): 1.30
    ACD/BCF (pH 7.4): 1.23
    ACD/KOC (pH 7.4): 6.51
    Polar Surface Area: 12 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 28.7±3.0 dyne/cm
    Molar Volume: 221.7±3.0 cm3

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