ChemSpider 2D Image | 5-[(3-Chloro-6-hydrazino-2-pyridinyl)methyl]-1-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one | C12H12ClN7O

5-[(3-Chloro-6-hydrazino-2-pyridinyl)methyl]-1-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

  • Molecular FormulaC12H12ClN7O
  • Average mass305.723 Da
  • Monoisotopic mass305.079193 Da
  • ChemSpider ID43441486

More details:

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

4H-Pyrazolo[3,4-d]pyrimidin-4-one, 5-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-1,5-dihydro-1-methyl- [ACD/Index Name]
5-[(3-Chlor-6-hydrazino-2-pyridinyl)methyl]-1-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-on [German] [ACD/IUPAC Name]
5-[(3-Chloro-6-hydrazino-2-pyridinyl)methyl]-1-methyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one [ACD/IUPAC Name]
5-[(3-Chloro-6-hydrazino-2-pyridinyl)méthyl]-1-méthyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one [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: 570.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 298.7±32.9 °C
Index of Refraction: 1.789
Molar Refractivity: 77.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.01
ACD/LogD (pH 5.5): 0.31
ACD/BCF (pH 5.5): 1.01
ACD/KOC (pH 5.5): 34.71
ACD/LogD (pH 7.4): 0.33
ACD/BCF (pH 7.4): 1.05
ACD/KOC (pH 7.4): 36.06
Polar Surface Area: 101 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 72.5±7.0 dyne/cm
Molar Volume: 183.2±7.0 cm3

Click to predict properties on the Chemicalize site


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