Found 350 results

Search term: MF = 'C_{13}H_{18}N_{8}'
ChemSpider 2D Image | N~6~-[(1,5-Dimethyl-1H-pyrazol-4-yl)methyl]-8,9-dimethyl-9H-purine-2,6-diamine | C13H18N8

N6-[(1,5-Dimethyl-1H-pyrazol-4-yl)methyl]-8,9-dimethyl-9H-purine-2,6-diamine

  • Molecular FormulaC13H18N8
  • Average mass286.336 Da
  • Monoisotopic mass286.165436 Da
  • ChemSpider ID31036888

More details:

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

9H-Purine-2,6-diamine, N6-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-8,9-dimethyl- [ACD/Index Name]
N6-[(1,5-Dimethyl-1H-pyrazol-4-yl)methyl]-8,9-dimethyl-9H-purin-2,6-diamin [German] [ACD/IUPAC Name]
N6-[(1,5-Dimethyl-1H-pyrazol-4-yl)methyl]-8,9-dimethyl-9H-purine-2,6-diamine [ACD/IUPAC Name]
N6-[(1,5-Diméthyl-1H-pyrazol-4-yl)méthyl]-8,9-diméthyl-9H-purine-2,6-diamine [French] [ACD/IUPAC Name]
N6-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-8,9-dimethyl-9H-purine-2,6-diamine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 609.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 322.3±34.3 °C
Index of Refraction: 1.747
Molar Refractivity: 79.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.20
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 16.55
ACD/KOC (pH 5.5): 219.94
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.33
ACD/KOC (pH 7.4): 389.65
Polar Surface Area: 99 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 194.8±7.0 cm3

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