ChemSpider 2D Image | 5,7-Dimethyl-2-(methylsulfonyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione | C8H10N4O4S

5,7-Dimethyl-2-(methylsulfonyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione

  • Molecular FormulaC8H10N4O4S
  • Average mass258.254 Da
  • Monoisotopic mass258.042267 Da
  • ChemSpider ID22987261

More details:

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

2H-Pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 5,7-dimethyl-2-(methylsulfonyl)- [ACD/Index Name]
5,7-Dimethyl-2-(methylsulfonyl)-2H-pyrazolo[3,4-d]pyrimidin-4,6(5H,7H)-dion [German] [ACD/IUPAC Name]
5,7-Dimethyl-2-(methylsulfonyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione [ACD/IUPAC Name]
5,7-Diméthyl-2-(méthylsulfonyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 474.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 240.8±31.5 °C
Index of Refraction: 1.711
Molar Refractivity: 60.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.05
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.31
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.31
Polar Surface Area: 101 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 70.5±7.0 dyne/cm
Molar Volume: 153.8±7.0 cm3

Click to predict properties on the Chemicalize site


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