ChemSpider 2D Image | 8-Amino-7-(2-methoxyethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione | C10H15N5O3

8-Amino-7-(2-methoxyethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione

  • Molecular FormulaC10H15N5O3
  • Average mass253.258 Da
  • Monoisotopic mass253.117493 Da
  • ChemSpider ID28611771

More details:

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

1370594-76-5 [RN]
1H-Purine-2,6-dione, 8-amino-3,7-dihydro-7-(2-methoxyethyl)-1,3-dimethyl- [ACD/Index Name]
8-Amino-7-(2-methoxyethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
8-Amino-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
8-Amino-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
8-Amino-7-(2-méthoxyéthyl)-1,3-diméthyl-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]
8-Amino-7-(2-methoxy-ethyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
8-amino-7-(2-methoxyethyl)-1,3-dimethylpurine-2,6-dione
AKOS015831224
MCULE-7773868456
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 480.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.5±3.0 kJ/mol
    Flash Point: 244.6±31.5 °C
    Index of Refraction: 1.667
    Molar Refractivity: 62.9±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.20
    ACD/LogD (pH 5.5): 0.19
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 30.16
    ACD/LogD (pH 7.4): 0.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 30.16
    Polar Surface Area: 94 Å2
    Polarizability: 24.9±0.5 10-24cm3
    Surface Tension: 58.9±7.0 dyne/cm
    Molar Volume: 169.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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