ChemSpider 2D Image | 4,6-Dichloro-3-isobutyl-1H-pyrazolo[3,4-d]pyrimidine | C9H10Cl2N4

4,6-Dichloro-3-isobutyl-1H-pyrazolo[3,4-d]pyrimidine

  • Molecular FormulaC9H10Cl2N4
  • Average mass245.109 Da
  • Monoisotopic mass244.028259 Da
  • ChemSpider ID30916447

More details:

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

1H-Pyrazolo[3,4-d]pyrimidine, 4,6-dichloro-3-(2-methylpropyl)- [ACD/Index Name]
4,6-Dichlor-3-isobutyl-1H-pyrazolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
4,6-Dichloro-3-isobutyl-1H-pyrazolo[3,4-d]pyrimidine [ACD/IUPAC Name]
4,6-Dichloro-3-isobutyl-1H-pyrazolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
1273577-34-6 [RN]
1h-pyrazolo[3,4-d]pyrimidine,4,6-dichloro-3-(2-methylpropyl)-
MFCD18633598

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

Density: 1.4±0.1 g/cm3
Boiling Point: 356.0±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 57.8±3.0 kJ/mol
Flash Point: 200.3±8.5 °C
Index of Refraction: 1.634
Molar Refractivity: 61.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 73.39
ACD/KOC (pH 5.5): 752.65
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 57.21
ACD/KOC (pH 7.4): 586.75
Polar Surface Area: 54 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 171.7±3.0 cm3

Click to predict properties on the Chemicalize site


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