ChemSpider 2D Image | 5-Benzyl-5-azaspiro[2.4]heptane | C13H17N

5-Benzyl-5-azaspiro[2.4]heptane

  • Molecular FormulaC13H17N
  • Average mass187.281 Da
  • Monoisotopic mass187.136093 Da
  • ChemSpider ID28535221

More details:

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

1204875-03-5 [RN]
5-Azaspiro[2.4]heptane, 5-(phenylmethyl)- [ACD/Index Name]
5-Benzyl-5-azaspiro[2.4]heptan [German] [ACD/IUPAC Name]
5-Benzyl-5-azaspiro[2.4]heptane [ACD/IUPAC Name]
5-Benzyl-5-azaspiro[2.4]heptane [French] [ACD/IUPAC Name]
[1204875-03-5] [RN]
347146-14-9 [RN]
5-Benzyl-5-aza-spiro[2.4]heptane
MFCD21099572 [MDL number]

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

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 270.6±9.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.9±3.0 kJ/mol
    Flash Point: 107.4±15.6 °C
    Index of Refraction: 1.591
    Molar Refractivity: 59.0±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.58
    ACD/LogD (pH 5.5): -0.34
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 7.51
    Polar Surface Area: 3 Å2
    Polarizability: 23.4±0.5 10-24cm3
    Surface Tension: 43.3±5.0 dyne/cm
    Molar Volume: 174.5±5.0 cm3

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