ChemSpider 2D Image | 8-Amino-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione | C14H14FN5O2

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

  • Molecular FormulaC14H14FN5O2
  • Average mass303.292 Da
  • Monoisotopic mass303.113159 Da
  • ChemSpider ID28611775

More details:

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

1H-Purine-2,6-dione, 8-amino-7-[(2-fluorophenyl)methyl]-3,7-dihydro-1,3-dimethyl- [ACD/Index Name]
8-Amino-7-(2-fluorbenzyl)-1,3-dimethyl-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
8-Amino-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
8-Amino-7-(2-fluorobenzyl)-1,3-diméthyl-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]
1370594-90-3 [RN]
8-Amino-7-(2-fluoro-benzyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
8-amino-7-[(2-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
AKOS015831261
MCULE-7283217918
MFCD22192665
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 551.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 83.1±3.0 kJ/mol
    Flash Point: 287.2±32.9 °C
    Index of Refraction: 1.693
    Molar Refractivity: 77.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.62
    ACD/LogD (pH 5.5): 2.17
    ACD/BCF (pH 5.5): 26.16
    ACD/KOC (pH 5.5): 360.06
    ACD/LogD (pH 7.4): 2.17
    ACD/BCF (pH 7.4): 26.17
    ACD/KOC (pH 7.4): 360.09
    Polar Surface Area: 84 Å2
    Polarizability: 30.7±0.5 10-24cm3
    Surface Tension: 57.4±7.0 dyne/cm
    Molar Volume: 202.1±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement