ChemSpider 2D Image | MFCD17017542 | C5H9NS

MFCD17017542

  • Molecular FormulaC5H9NS
  • Average mass115.197 Da
  • Monoisotopic mass115.045570 Da
  • ChemSpider ID32967821

More details:

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

2-Thia-6-azaspiro[3.3]heptan [German] [ACD/IUPAC Name]
2-Thia-6-azaspiro[3.3]heptane [ACD/Index Name] [ACD/IUPAC Name]
2-Thia-6-azaspiro[3.3]heptane [French] [ACD/Index Name] [ACD/IUPAC Name]
920491-09-4 [RN]
MFCD17017542
2-Thia-6-azaspiro[3.3]heptane hemioxalate
2-thia-6-aza-spiro[3.3]heptane(wx100438)
2-THIA-6-AZASPIRO[3.3]HEPTANE|2-THIA-6-AZASPIRO[3.3]HEPTANE
6-thia-2-azaspiro[3.3]heptane

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 209.1±40.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 44.5±3.0 kJ/mol
    Flash Point: 80.3±27.3 °C
    Index of Refraction: 1.600
    Molar Refractivity: 32.8±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.30
    ACD/LogD (pH 5.5): -2.44
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.55
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 37 Å2
    Polarizability: 13.0±0.5 10-24cm3
    Surface Tension: 44.9±5.0 dyne/cm
    Molar Volume: 95.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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