ChemSpider 2D Image | N-[(3S)-Oxan-3-yl]benzamide | C12H15NO2

N-[(3S)-Oxan-3-yl]benzamide

  • Molecular FormulaC12H15NO2
  • Average mass205.253 Da
  • Monoisotopic mass205.110275 Da
  • ChemSpider ID26528427

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2165689-24-5 [RN]
Benzamide, N-[(3S)-tetrahydro-2H-pyran-3-yl]- [ACD/Index Name]
N-[(3S)-Oxan-3-yl]benzamide
N-[(3S)-Tetrahydro-2H-pyran-3-yl]benzamid [German] [ACD/IUPAC Name]
N-[(3S)-Tetrahydro-2H-pyran-3-yl]benzamide [ACD/IUPAC Name]
N-[(3S)-Tétrahydro-2H-pyran-3-yl]benzamide [French] [ACD/IUPAC Name]
(S)-N-(tetrahydro-2H-pyran-3-yl)benzamide
1310412-60-2 [RN]
BenzaMide, N-(tetrahydro-2H-pyran-3-yl)-, (3R)-
MFCD17677272 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 411.5±38.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.4±3.0 kJ/mol
    Flash Point: 202.6±26.8 °C
    Index of Refraction: 1.551
    Molar Refractivity: 58.0±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.07
    ACD/LogD (pH 5.5): 1.55
    ACD/BCF (pH 5.5): 8.89
    ACD/KOC (pH 5.5): 166.25
    ACD/LogD (pH 7.4): 1.55
    ACD/BCF (pH 7.4): 8.89
    ACD/KOC (pH 7.4): 166.25
    Polar Surface Area: 38 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 43.4±5.0 dyne/cm
    Molar Volume: 181.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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