ChemSpider 2D Image | Diethyl 1,12-bis(4-chlorophenyl)-1,12,12a,12b-tetrahydrobis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxaline-3,10-dicarboxylate | C28H24Cl2N6O4

Diethyl 1,12-bis(4-chlorophenyl)-1,12,12a,12b-tetrahydrobis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxaline-3,10-dicarboxylate

  • Molecular FormulaC28H24Cl2N6O4
  • Average mass579.434 Da
  • Monoisotopic mass578.123596 Da
  • ChemSpider ID28488529

More details:

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

1,12-Bis(4-chlorophényl)-1,12,12a,12b-tétrahydrobis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxaline-3,10-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
1,2,4-Triazolo[4,3-a][1,2,4]triazolo[3,4-c]quinoxaline-3,10-dicarboxylic acid, 1,12-bis(4-chlorophenyl)-1,12,12a,12b-tetrahydro-, diethyl ester [ACD/Index Name]
Diethyl 1,12-bis(4-chlorophenyl)-1,12,12a,12b-tetrahydrobis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxaline-3,10-dicarboxylate [ACD/IUPAC Name]
Diethyl-1,12-bis(4-chlorphenyl)-1,12,12a,12b-tetrahydrobis[1,2,4]triazolo[4,3-a:3',4'-c]chinoxalin-3,10-dicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 665.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.4±34.3 °C
Index of Refraction: 1.708
Molar Refractivity: 151.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.75
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 90 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 58.6±7.0 dyne/cm
Molar Volume: 388.5±7.0 cm3

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