ChemSpider 2D Image | Liberine | C8H10N4O3

Liberine

  • Molecular FormulaC8H10N4O3
  • Average mass210.190 Da
  • Monoisotopic mass210.075287 Da
  • ChemSpider ID48060240

More details:

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

1H-Purine-6,8-dione, 7,9-dihydro-2-methoxy-1,9-dimethyl- [ACD/Index Name]
2-Methoxy-1,9-dimethyl-7,9-dihydro-1H-purin-6,8-dion [German] [ACD/IUPAC Name]
2-Methoxy-1,9-dimethyl-7,9-dihydro-1H-purine-6,8-dione [ACD/IUPAC Name]
2-Méthoxy-1,9-diméthyl-7,9-dihydro-1H-purine-6,8-dione [French] [ACD/IUPAC Name]
Liberine [Wiki]
2-methoxy-1,9-dimethyl-7H-purine-6,8-dione
56119-16-5 [RN]
O(2),1,9-trimethylurate
O(2),1,9-trimethyluric acid
O(2),1,9-trimethyluric acid|liberine

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: 1.685
Molar Refractivity: 50.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.59
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.29
Polar Surface Area: 74 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 58.0±7.0 dyne/cm
Molar Volume: 133.8±7.0 cm3

Click to predict properties on the Chemicalize site


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