ChemSpider 2D Image | 6-(p-Toluenesulfonyl)-2-oxa-6-azaspiro[3.3]heptane | C12H15NO3S

6-(p-Toluenesulfonyl)-2-oxa-6-azaspiro[3.3]heptane

  • Molecular FormulaC12H15NO3S
  • Average mass253.317 Da
  • Monoisotopic mass253.077271 Da
  • ChemSpider ID14913487

More details:

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

13573-28-9 [RN]
2-Oxa-6-azaspiro[3.3]heptane, 6-[(4-methylphenyl)sulfonyl]- [ACD/Index Name]
6-(4-methylbenzenesulfonyl)-2-oxa-6-azaspiro[3.3]heptane
6-(p-Toluenesulfonyl)-2-oxa-6-azaspiro[3.3]heptane
6-[(4-Methylphenyl)sulfonyl]-2-oxa-6-azaspiro[3.3]heptan
6-[(4-Methylphenyl)sulfonyl]-2-oxa-6-azaspiro[3.3]heptan [German] [ACD/IUPAC Name]
6-[(4-Methylphenyl)sulfonyl]-2-oxa-6-azaspiro[3.3]heptane [ACD/IUPAC Name]
6-[(4-Méthylphényl)sulfonyl]-2-oxa-6-azaspiro[3.3]heptane [French] [ACD/IUPAC Name]
[13573-28-9] [RN]
2-(p-tolylsulfonyl)-6-oxa-2-azaspiro[3.3]heptane
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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: 1.4±0.1 g/cm3
    Boiling Point: 411.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.3±3.0 kJ/mol
    Flash Point: 202.3±31.5 °C
    Index of Refraction: 1.625
    Molar Refractivity: 64.9±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.66
    ACD/LogD (pH 5.5): 1.79
    ACD/BCF (pH 5.5): 13.49
    ACD/KOC (pH 5.5): 224.09
    ACD/LogD (pH 7.4): 1.79
    ACD/BCF (pH 7.4): 13.49
    ACD/KOC (pH 7.4): 224.09
    Polar Surface Area: 55 Å2
    Polarizability: 25.7±0.5 10-24cm3
    Surface Tension: 57.7±5.0 dyne/cm
    Molar Volume: 183.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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