ChemSpider 2D Image | Dimethyl 8,9,10,11-tetraethyl-1,4,6,13-tetrapropyl-2,3-pentacenedicarboxylate | C46H58O4

Dimethyl 8,9,10,11-tetraethyl-1,4,6,13-tetrapropyl-2,3-pentacenedicarboxylate

  • Molecular FormulaC46H58O4
  • Average mass674.950 Da
  • Monoisotopic mass674.433533 Da
  • ChemSpider ID10147824

More details:

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

2,3-Pentacenedicarboxylic acid, 8,9,10,11-tetraethyl-1,4,6,13-tetrapropyl-, dimethyl ester [ACD/Index Name]
8,9,10,11-Tétraéthyl-1,4,6,13-tétrapropyl-2,3-pentacènedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 8,9,10,11-tetraethyl-1,4,6,13-tetrapropyl-2,3-pentacenedicarboxylate [ACD/IUPAC Name]
Dimethyl-8,9,10,11-tetraethyl-1,4,6,13-tetrapropyl-2,3-pentacendicarboxylat [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: 787.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.6±3.0 kJ/mol
Flash Point: 393.4±31.3 °C
Index of Refraction: 1.602
Molar Refractivity: 216.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 16.62
ACD/LogD (pH 5.5): 14.50
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.50
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 53 Å2
Polarizability: 85.7±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 630.2±3.0 cm3

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