ChemSpider 2D Image | 3,3'-Diethyl 1,1'-[(9-octyl-9H-carbazole-3,6-diyl)bis(methylene)] dimalonate | C32H41NO8

3,3'-Diethyl 1,1'-[(9-octyl-9H-carbazole-3,6-diyl)bis(methylene)] dimalonate

  • Molecular FormulaC32H41NO8
  • Average mass567.670 Da
  • Monoisotopic mass567.283203 Da
  • ChemSpider ID9562424

More details:

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

3,3'-Diethyl 1,1'-[(9-octyl-9H-carbazole-3,6-diyl)bis(methylene)] dimalonate [ACD/IUPAC Name]
3,3'-Diethyl-1,1'-[(9-octyl-9H-carbazol-3,6-diyl)dimethylen]-dimalonat [German] [ACD/IUPAC Name]
Dimalonate de 3,3'-diéthyle et de 1,1'-[(9-octyl-9H-carbazole-3,6-diyl)diméthylène] [French] [ACD/IUPAC Name]
Propanedioic acid, 3,3'-diethyl 1,1'-[(9-octyl-9H-carbazole-3,6-diyl)bis(methylene)] ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 618.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 327.6±31.5 °C
Index of Refraction: 1.552
Molar Refractivity: 154.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 7.31
ACD/LogD (pH 5.5): 7.69
ACD/BCF (pH 5.5): 411272.38
ACD/KOC (pH 5.5): 363216.75
ACD/LogD (pH 7.4): 7.69
ACD/BCF (pH 7.4): 411210.53
ACD/KOC (pH 7.4): 363162.13
Polar Surface Area: 110 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 484.6±7.0 cm3

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