ChemSpider 2D Image | 8-[2,3-Difluoro-4-(hexyloxy)phenyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione | C19H22F2N4O3

8-[2,3-Difluoro-4-(hexyloxy)phenyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

  • Molecular FormulaC19H22F2N4O3
  • Average mass392.400 Da
  • Monoisotopic mass392.165985 Da
  • ChemSpider ID58191897

More details:

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

1H-Purine-2,6-dione, 8-[2,3-difluoro-4-(hexyloxy)phenyl]-3,7-dihydro-3,7-dimethyl- [ACD/Index Name]
8-[2,3-Difluor-4-(hexyloxy)phenyl]-3,7-dimethyl-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
8-[2,3-Difluoro-4-(hexyloxy)phenyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
8-[2,3-Difluoro-4-(hexyloxy)phényl]-3,7-diméthyl-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.602
Molar Refractivity: 98.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 258.92
ACD/KOC (pH 5.5): 1857.53
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 257.09
ACD/KOC (pH 7.4): 1844.41
Polar Surface Area: 76 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 43.5±7.0 dyne/cm
Molar Volume: 288.0±7.0 cm3

Click to predict properties on the Chemicalize site


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