ChemSpider 2D Image | 6-(Benzoylamino)-9-ethyl-7-methyl-8,9-dihydro-7H-purin-3-ium | C15H18N5O

6-(Benzoylamino)-9-ethyl-7-methyl-8,9-dihydro-7H-purin-3-ium

  • Molecular FormulaC15H18N5O
  • Average mass284.336 Da
  • Monoisotopic mass284.150574 Da
  • ChemSpider ID95743660

  • Charge - Charge

More details:

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

6-(Benzoylamino)-9-ethyl-7-methyl-8,9-dihydro-7H-purin-3-ium [German] [ACD/IUPAC Name]
6-(Benzoylamino)-9-ethyl-7-methyl-8,9-dihydro-7H-purin-3-ium [ACD/IUPAC Name]
6-(Benzoylamino)-9-éthyl-7-méthyl-8,9-dihydro-7H-purin-3-ium [French] [ACD/IUPAC Name]
Benzamide, N-(9-ethyl-8,9-dihydro-7-methyl-7H-purin-6-yl)-, conjugate monoacid [ACD/Index Name]

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

Density:
Boiling Point: 393.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 191.6±27.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 1.75
ACD/BCF (pH 5.5): 7.84
ACD/KOC (pH 5.5): 87.64
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 48.54
ACD/KOC (pH 7.4): 542.28
Polar Surface Area: 63 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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