ChemSpider 2D Image | 3,6-Diamino-3aH-pyrazolo[3,4-b]pyrazine-5-carboxylic acid | C6H6N6O2

3,6-Diamino-3aH-pyrazolo[3,4-b]pyrazine-5-carboxylic acid

  • Molecular FormulaC6H6N6O2
  • Average mass194.151 Da
  • Monoisotopic mass194.055222 Da
  • ChemSpider ID24197466

More details:

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

3,6-Diamino-3aH-pyrazolo[3,4-b]pyrazin-5-carbonsäure [German] [ACD/IUPAC Name]
3,6-Diamino-3aH-pyrazolo[3,4-b]pyrazine-5-carboxylic acid [ACD/IUPAC Name]
3aH-Pyrazolo[3,4-b]pyrazine-5-carboxylic acid, 3,6-diamino- [ACD/Index Name]
Acide 3,6-diamino-3aH-pyrazolo[3,4-b]pyrazine-5-carboxylique [French] [ACD/IUPAC Name]
3AH-PYRAZOLO[3,4-B]PYRAZINE-5-CARBOXYLIC ACID 3,6-DIAMINO-
3aH-Pyrazolo[3,4-b]pyrazine-5-carboxylic acid, 3,6-diamino- (9CI)
3AH-PYRAZOLO[3,4-B]PYRAZINE-5-CARBOXYLICACID, 3,6-DIAMINO-
791022-66-7 [RN]

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

Density: 2.5±0.1 g/cm3
Boiling Point: 481.3±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.7±6.0 kJ/mol
Flash Point: 244.9±24.0 °C
Index of Refraction: 2.131
Molar Refractivity: 42.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: -2.59
ACD/LogD (pH 5.5): -4.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 139 Å2
Polarizability: 17.0±0.5 10-24cm3
Surface Tension: 159.2±7.0 dyne/cm
Molar Volume: 79.1±7.0 cm3

Click to predict properties on the Chemicalize site


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