ChemSpider 2D Image | Diethyl 4,6-diisopropyl-2-[6-(5-methyl-2-naphthyl)-1H-indol-2-yl]isophthalate | C37H39NO4

Diethyl 4,6-diisopropyl-2-[6-(5-methyl-2-naphthyl)-1H-indol-2-yl]isophthalate

  • Molecular FormulaC37H39NO4
  • Average mass561.710 Da
  • Monoisotopic mass561.287903 Da
  • ChemSpider ID128727742

More details:






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

1,3-Benzenedicarboxylic acid, 4,6-bis(1-methylethyl)-2-[6-(5-methyl-2-naphthalenyl)-1H-indol-2-yl]-, diethyl ester [ACD/Index Name]
4,6-Diisopropyl-2-[6-(5-méthyl-2-naphtyl)-1H-indol-2-yl]isophtalate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 4,6-diisopropyl-2-[6-(5-methyl-2-naphthyl)-1H-indol-2-yl]isophthalate [ACD/IUPAC Name]
Diethyl-4,6-diisopropyl-2-[6-(5-methyl-2-naphthyl)-1H-indol-2-yl]isophthalat [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: 743.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 403.5±32.9 °C
Index of Refraction: 1.615
Molar Refractivity: 171.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 11.49
ACD/LogD (pH 5.5): 9.58
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3883117.00
ACD/LogD (pH 7.4): 9.58
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3883117.00
Polar Surface Area: 68 Å2
Polarizability: 68.0±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 491.8±3.0 cm3

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