ChemSpider 2D Image | 2',3'-O-Isopropylideneadenosine | C13H17N5O4

2',3'-O-Isopropylideneadenosine

  • Molecular FormulaC13H17N5O4
  • Average mass307.305 Da
  • Monoisotopic mass307.128052 Da
  • ChemSpider ID35518588

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

2',3'-O-Isopropylidenadenosin [German] [ACD/IUPAC Name]
2',3'-O-Isopropylideneadenosine [ACD/IUPAC Name]
2',3'-O-Isopropylidèneadénosine [French] [ACD/IUPAC Name]
Adenosine, 2',3'-O-(1-methylethylidene)- [ACD/Index Name]
((3aS,4R,6R)-6-(6-amino-9H-purin-9-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methanol
[(4R,6R,6aS)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol
2',3'-isopropylideneadenosine
2,3-o-Isopropylideneadenosine
362-75-4 [RN]
MFCD00005756 [MDL number]

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 570.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.0±3.0 kJ/mol
    Flash Point: 298.8±32.9 °C
    Index of Refraction: 1.797
    Molar Refractivity: 72.5±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.15
    ACD/LogD (pH 5.5): 1.02
    ACD/BCF (pH 5.5): 3.50
    ACD/KOC (pH 5.5): 84.76
    ACD/LogD (pH 7.4): 1.03
    ACD/BCF (pH 7.4): 3.58
    ACD/KOC (pH 7.4): 86.66
    Polar Surface Area: 118 Å2
    Polarizability: 28.7±0.5 10-24cm3
    Surface Tension: 75.3±7.0 dyne/cm
    Molar Volume: 170.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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