Found 83 results

Search term: MF = 'C_{13}H_{22}O_{7}'
ChemSpider 2D Image | (3xi)-1-O-Butyryl-2,3-O-isopropylidene-alpha-D-ribo-hexofuranose | C13H22O7

(3ξ)-1-O-Butyryl-2,3-O-isopropylidene-α-D-ribo-hexofuranose

  • Molecular FormulaC13H22O7
  • Average mass290.310 Da
  • Monoisotopic mass290.136566 Da
  • ChemSpider ID57564952

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

(3ξ)-1-O-Butyryl-2,3-O-isopropylidene-α-D-ribo-hexofuranose [ACD/IUPAC Name]
(3ξ)-1-O-Butyryl-2,3-O-isopropylidène-α-D-ribo-hexofuranose [French] [ACD/IUPAC Name]
(3ξ)-1-O-Butyryl-2,3-O-isopropyliden-α-D-ribo-hexofuranose [German] [ACD/IUPAC Name]
α-D-ribo-Hexofuranose, 2,3-O-(1-methylethylidene)-, 1-butanoate, (3ξ)- [ACD/Index Name]
(3aR,4R,6R)-6-(1,2-dihydroxyethyl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl butyrate
177562-15-1 [RN]
o-n-butanoyl-2,3-o-diisopropylidene-??-d-mannofuranoside
O-n-Butanoyl-2,3-O-diisopropylidene-α-D-mannofuranoside
PUBCHEM_57347655

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 423.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.3±6.0 kJ/mol
    Flash Point: 155.2±22.2 °C
    Index of Refraction: 1.515
    Molar Refractivity: 68.2±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.24
    ACD/LogD (pH 5.5): 1.01
    ACD/BCF (pH 5.5): 3.45
    ACD/KOC (pH 5.5): 84.46
    ACD/LogD (pH 7.4): 1.01
    ACD/BCF (pH 7.4): 3.45
    ACD/KOC (pH 7.4): 84.46
    Polar Surface Area: 94 Å2
    Polarizability: 27.0±0.5 10-24cm3
    Surface Tension: 49.2±5.0 dyne/cm
    Molar Volume: 226.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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