ChemSpider 2D Image | (3aS,5R,6S,6aS)-2,2-dimethyl-5-(morpholine-4-carbonyl)-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol | C12H19NO6

(3aS,5R,6S,6aS)-2,2-dimethyl-5-(morpholine-4-carbonyl)-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol

  • Molecular FormulaC12H19NO6
  • Average mass273.282 Da
  • Monoisotopic mass273.121246 Da
  • ChemSpider ID34500390

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3aS,5R,6S,6aS)-2,2-dimethyl-5-(morpholine-4-carbonyl)-tetrahydro-2H-furo[2,3-d][1,3]dioxol-6-ol
(3aS,5R,6S,6aS)-2,2-dimethyl-5-(morpholine-4-carbonyl)-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol
[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)methanon (non-preferred name) [German] [ACD/IUPAC Name]
[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)methanone (non-preferred name) [ACD/IUPAC Name]
[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-diméthyltétrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)méthanone (non-preferred name) [French] [ACD/IUPAC Name]
1103738-19-7 [RN]
((3AS,5R,6S,6aS)-6-hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl)(morpholino)methanone
((3as,5r,6s,6as)-6-hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl)(morpholino)methanone(wx180137)
[(3aS,5R,6S,6aS)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-morpholin-4-ylmethanone
[(3as,5r,6s,6as)-6-hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](morpholino)methanone
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 479.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 85.7±6.0 kJ/mol
    Flash Point: 243.7±28.7 °C
    Index of Refraction: 1.520
    Molar Refractivity: 63.0±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.63
    ACD/LogD (pH 5.5): 0.21
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 31.09
    ACD/LogD (pH 7.4): 0.21
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 31.09
    Polar Surface Area: 77 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 46.1±3.0 dyne/cm
    Molar Volume: 207.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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