ChemSpider 2D Image | 4-{(E)-[(9-Ethyl-9H-carbazol-3-yl)imino]methyl}-1,3-phenylene di(2-furoate) | C31H22N2O6

4-{(E)-[(9-Ethyl-9H-carbazol-3-yl)imino]methyl}-1,3-phenylene di(2-furoate)

  • Molecular FormulaC31H22N2O6
  • Average mass518.516 Da
  • Monoisotopic mass518.147766 Da
  • ChemSpider ID3290685

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Furancarboxylic acid, 4-[(E)-[(9-ethyl-9H-carbazol-3-yl)imino]methyl]-1,3-phenylene ester [ACD/Index Name]
4-{(E)-[(9-Ethyl-9H-carbazol-3-yl)imino]methyl}-1,3-phenylen-di(2-furoat) [German] [ACD/IUPAC Name]
4-{(E)-[(9-Ethyl-9H-carbazol-3-yl)imino]methyl}-1,3-phenylene di(2-furoate) [ACD/IUPAC Name]
Di(2-furoate) de 4-{(E)-[(9-éthyl-9H-carbazol-3-yl)imino]méthyl}-1,3-phénylène [French] [ACD/IUPAC Name]
[2-[(E)-(9-ETHYLCARBAZOL-3-YL)IMINOMETHYL]-5-(FURAN-2-CARBONYLOXY)PHENYL] FURAN-2-CARBOXYLATE
2-[(1E)-[(9-ETHYL-9H-CARBAZOL-3-YL)IMINO]METHYL]-5-(FURAN-2-CARBONYLOXY)PHENYL FURAN-2-CARBOXYLATE
2-[(1E)-[(9-ETHYLCARBAZOL-3-YL)IMINO]METHYL]-5-(FURAN-2-CARBONYLOXY)PHENYL FURAN-2-CARBOXYLATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 689.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 370.8±31.5 °C
Index of Refraction: 1.651
Molar Refractivity: 144.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 5.61
ACD/BCF (pH 5.5): 10745.87
ACD/KOC (pH 5.5): 26713.23
ACD/LogD (pH 7.4): 5.61
ACD/BCF (pH 7.4): 10782.49
ACD/KOC (pH 7.4): 26804.28
Polar Surface Area: 96 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 394.9±7.0 cm3

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