ChemSpider 2D Image | 7-(2,4-Dichlorobenzyl)-8-{2-methoxy-4-[(phenylhydrazono)methyl]phenoxy}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione | C28H24Cl2N6O4

7-(2,4-Dichlorobenzyl)-8-{2-methoxy-4-[(phenylhydrazono)methyl]phenoxy}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

  • Molecular FormulaC28H24Cl2N6O4
  • Average mass579.434 Da
  • Monoisotopic mass578.123596 Da
  • ChemSpider ID3126180

More details:

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

7-(2,4-Dichlorbenzyl)-8-{2-methoxy-4-[(phenylhydrazono)methyl]phenoxy}-1,3-dimethyl-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
7-(2,4-Dichlorobenzyl)-8-{2-methoxy-4-[(phenylhydrazono)methyl]phenoxy}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
7-(2,4-Dichlorobenzyl)-8-{2-méthoxy-4-[(phénylhydrazono)méthyl]phénoxy}-1,3-diméthyl-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]
Benzaldehyde, 4-[[7-[(2,4-dichlorophenyl)methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]oxy]-3-methoxy-, 1-(2-phenylhydrazone) [ACD/Index 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: 769.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 419.4±35.7 °C
Index of Refraction: 1.669
Molar Refractivity: 153.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 7.46
ACD/LogD (pH 5.5): 6.47
ACD/BCF (pH 5.5): 49089.22
ACD/KOC (pH 5.5): 79320.41
ACD/LogD (pH 7.4): 6.47
ACD/BCF (pH 7.4): 49091.16
ACD/KOC (pH 7.4): 79323.55
Polar Surface Area: 101 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 410.0±7.0 cm3

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