ChemSpider 2D Image | (3aR,5S,6S,6aR)-5-[(4R)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-6-yl acetate (non-preferred name) | C14H22O7

(3aR,5S,6S,6aR)-5-[(4R)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-6-yl acetate (non-preferred name)

  • Molecular FormulaC14H22O7
  • Average mass302.320 Da
  • Monoisotopic mass302.136566 Da
  • ChemSpider ID57267287

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(3aR,5S,6S,6aR)-5-[(4R)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-6-yl acetate (non-preferred name) [ACD/IUPAC Name]
(3aR,5S,6S,6aR)-5-[(4R)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-6-yl-acetat (non-preferred name) [German] [ACD/IUPAC Name]
Acétate de (3aR,5S,6S,6aR)-5-[(4R)-2,2-diméthyl-1,3-dioxolan-4-yl]-2,2-diméthyltétrahydrofuro[2,3-d][1,3]dioxol-6-yle (non-preferred name) [French] [ACD/IUPAC Name]
[(3Ar,5S,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate
38166-65-3 [RN]
3-O-Acetyl-1,2:5,6-di-O-isopropylidene-a-D-galactofuranose
3-O-acetyl-1,2:5,6-di-O-isopropylidene-α-D-galactofuranose
MFCD00080757 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 350.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.5±3.0 kJ/mol
    Flash Point: 151.4±27.9 °C
    Index of Refraction: 1.502
    Molar Refractivity: 71.2±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.52
    ACD/LogD (pH 5.5): 2.04
    ACD/BCF (pH 5.5): 20.94
    ACD/KOC (pH 5.5): 307.05
    ACD/LogD (pH 7.4): 2.04
    ACD/BCF (pH 7.4): 20.94
    ACD/KOC (pH 7.4): 307.05
    Polar Surface Area: 72 Å2
    Polarizability: 28.2±0.5 10-24cm3
    Surface Tension: 41.4±5.0 dyne/cm
    Molar Volume: 241.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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