ChemSpider 2D Image | (3S)-3-Aminodihydro-2H-pyran-2,6(3H)-dione | C5H7NO3

(3S)-3-Aminodihydro-2H-pyran-2,6(3H)-dione

  • Molecular FormulaC5H7NO3
  • Average mass129.114 Da
  • Monoisotopic mass129.042587 Da
  • ChemSpider ID21111873

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Aminodihydro-2H-pyran-2,6(3H)-dion [German] [ACD/IUPAC Name]
(3S)-3-Aminodihydro-2H-pyran-2,6(3H)-dione [ACD/IUPAC Name]
(3S)-3-Aminodihydro-2H-pyrane-2,6(3H)-dione [French] [ACD/IUPAC Name]
2H-Pyran-2,6(3H)-dione, 3-aminodihydro-, (3S)- [ACD/Index Name]
(3S)-3-Aminooxane-2,6-dione
(S)-3-Aminodihydro-2H-pyran-2,6(3H)-dione
48103-74-8 [RN]
glutamic anhydride

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

MFCD00006679 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 299.2±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.9±3.0 kJ/mol
    Flash Point: 191.4±21.7 °C
    Index of Refraction: 1.493
    Molar Refractivity: 28.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.93
    ACD/LogD (pH 5.5): -2.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.69
    Polar Surface Area: 69 Å2
    Polarizability: 11.3±0.5 10-24cm3
    Surface Tension: 48.7±3.0 dyne/cm
    Molar Volume: 98.1±3.0 cm3

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