ChemSpider 2D Image | 6-Hydroxy-3,7-dimethyl(2-~14~C)-3,7-dihydro-2H-purin-2-one | C614CH8N4O2

6-Hydroxy-3,7-dimethyl(2-14C)-3,7-dihydro-2H-purin-2-one

  • Molecular FormulaC614CH8N4O2
  • Average mass182.157 Da
  • Monoisotopic mass182.067963 Da
  • ChemSpider ID57268708

  • Non-standard isotope - Non-standard isotope

More details:

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

2H-Purin-2-one-2-14C, 3,7-dihydro-6-hydroxy-3,7-dimethyl- [ACD/Index Name]
6-Hydroxy-3,7-dimethyl(2-14C)-3,7-dihydro-2H-purin-2-on [German] [ACD/IUPAC Name]
6-Hydroxy-3,7-dimethyl(2-14C)-3,7-dihydro-2H-purin-2-one [ACD/IUPAC Name]
6-Hydroxy-3,7-diméthyl(2-14C)-3,7-dihydro-2H-purin-2-one [French] [ACD/IUPAC Name]
THEOBROMINE[2-14C]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.737
Molar Refractivity: 45.1±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 65.8±7.0 dyne/cm
Molar Volume: 112.1±7.0 cm3

Click to predict properties on the Chemicalize site


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