ChemSpider 2D Image | N~6~,1-Dimethyl-N~6~-[(3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine | C12H16N8

N6,1-Dimethyl-N6-[(3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

  • Molecular FormulaC12H16N8
  • Average mass272.309 Da
  • Monoisotopic mass272.149780 Da
  • ChemSpider ID70954760

More details:

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

1H-Pyrazolo[3,4-d]pyrimidine-4,6-diamine, N6,1-dimethyl-N6-[(3-methyl-1H-pyrazol-4-yl)methyl]- [ACD/Index Name]
N6,1-Dimethyl-N6-[(3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4,6-diamin [German] [ACD/IUPAC Name]
N6,1-Dimethyl-N6-[(3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine [ACD/IUPAC Name]
N6,1-Diméthyl-N6-[(3-méthyl-1H-pyrazol-4-yl)méthyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 602.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.4±34.3 °C
Index of Refraction: 1.771
Molar Refractivity: 74.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.86
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.19
ACD/KOC (pH 5.5): 30.21
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 2.96
ACD/KOC (pH 7.4): 75.21
Polar Surface Area: 102 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 62.5±7.0 dyne/cm
Molar Volume: 179.6±7.0 cm3

Click to predict properties on the Chemicalize site


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