ChemSpider 2D Image | Dibenzyl (6E)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(phenylhydrazono)-1,3-cyclohexanedicarboxylate | C36H36N2O5

Dibenzyl (6E)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(phenylhydrazono)-1,3-cyclohexanedicarboxylate

  • Molecular FormulaC36H36N2O5
  • Average mass576.681 Da
  • Monoisotopic mass576.262451 Da
  • ChemSpider ID7875144

  • Double-bond stereo - Double-bond stereo

More details:

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

(6E)-4-Hydroxy-4-méthyl-2-(4-méthylphényl)-6-(phénylhydrazono)-1,3-cyclohexanedicarboxylate de dibenzyle [French] [ACD/IUPAC Name]
1,3-Cyclohexanedicarboxylic acid, 4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(2-phenylhydrazinylidene)-, bis(phenylmethyl) ester, (6E)- [ACD/Index Name]
Dibenzyl (6E)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(phenylhydrazono)-1,3-cyclohexanedicarboxylate [ACD/IUPAC Name]
Dibenzyl (6E)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(phenylhydrazono)cyclohexane-1,3-dicarboxylate
Dibenzyl-(6E)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(phenylhydrazono)-1,3-cyclohexandicarboxylat [German] [ACD/IUPAC Name]
dibenzyl (6E)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-(2-phenylhydrazinylidene)cyclohexane-1,3-dicarboxylate
phenylmethyl 4-hydroxy-4-methyl-6-(4-methylphenyl)-2-[(phenylamino)azamethylene]-5-[benzyloxycarbonyl]cyclohexanecarboxylate

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

A3948/0168185 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 719.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.3±3.0 kJ/mol
Flash Point: 388.6±35.7 °C
Index of Refraction: 1.604
Molar Refractivity: 167.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.44
ACD/LogD (pH 5.5): 7.47
ACD/BCF (pH 5.5): 278340.41
ACD/KOC (pH 5.5): 274568.44
ACD/LogD (pH 7.4): 7.47
ACD/BCF (pH 7.4): 278676.78
ACD/KOC (pH 7.4): 274900.25
Polar Surface Area: 97 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 486.4±7.0 cm3

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