ChemSpider 2D Image | 1,6-Dimethyl-N-[3-(1H-1,2,3-triazol-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C12H16N8

1,6-Dimethyl-N-[3-(1H-1,2,3-triazol-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC12H16N8
  • Average mass272.309 Da
  • Monoisotopic mass272.149780 Da
  • ChemSpider ID29482022

More details:

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

1,6-Dimethyl-N-[3-(1H-1,2,3-triazol-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
1,6-Dimethyl-N-[3-(1H-1,2,3-triazol-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
1,6-Diméthyl-N-[3-(1H-1,2,3-triazol-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 1,6-dimethyl-N-[3-(1H-1,2,3-triazol-1-yl)propyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 450.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 226.3±31.5 °C
Index of Refraction: 1.741
Molar Refractivity: 76.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.03
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 2.99
ACD/KOC (pH 5.5): 73.85
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 3.34
ACD/KOC (pH 7.4): 82.44
Polar Surface Area: 86 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 188.4±7.0 cm3

Click to predict properties on the Chemicalize site


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