ChemSpider 2D Image | Diethyl 2,2'-{[(4-methylphenyl)imino]bis(methylene)}bis[1-(4-methylphenyl)-4,5-diphenyl-1H-pyrrole-3-carboxylate] | C61H55N3O4

Diethyl 2,2'-{[(4-methylphenyl)imino]bis(methylene)}bis[1-(4-methylphenyl)-4,5-diphenyl-1H-pyrrole-3-carboxylate]

  • Molecular FormulaC61H55N3O4
  • Average mass894.107 Da
  • Monoisotopic mass893.419250 Da
  • ChemSpider ID30659568

More details:

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

1H-Pyrrole-3-carboxylic acid, 2,2'-[[(4-methylphenyl)imino]bis(methylene)]bis[1-(4-methylphenyl)-4,5-diphenyl-, diethyl ester [ACD/Index Name]
2,2'-{[(4-Méthylphényl)imino]diméthylène}bis[1-(4-méthylphényl)-4,5-diphényl-1H-pyrrole-3-carboxylate] de diéthyle [French] [ACD/IUPAC Name]
Diethyl 2,2'-{[(4-methylphenyl)imino]bis(methylene)}bis[1-(4-methylphenyl)-4,5-diphenyl-1H-pyrrole-3-carboxylate] [ACD/IUPAC Name]
Diethyl-2,2'-{[(4-methylphenyl)imino]dimethylen}bis[1-(4-methylphenyl)-4,5-diphenyl-1H-pyrrol-3-carboxylat] [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.616
Molar Refractivity: 276.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 16.00
ACD/LogD (pH 5.5): 14.10
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.10
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 66 Å2
Polarizability: 109.5±0.5 10-24cm3
Surface Tension: 43.7±7.0 dyne/cm
Molar Volume: 790.1±7.0 cm3

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