ChemSpider 2D Image | N,N'-Di(2,3-dihydro-1H-inden-2-yl)-1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-2,2'-binaphthalene-5,5'-dicarboxamide | C42H36N2O8

N,N'-Di(2,3-dihydro-1H-inden-2-yl)-1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-2,2'-binaphthalene-5,5'-dicarboxamide

  • Molecular FormulaC42H36N2O8
  • Average mass696.744 Da
  • Monoisotopic mass696.247192 Da
  • ChemSpider ID24614007

More details:

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

[2,2'-Binaphthalene]-5,5'-dicarboxamide, N5,N5'-bis(2,3-dihydro-1H-inden-2-yl)-1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl- [ACD/Index Name]
N,N'-Di(2,3-dihydro-1H-indén-2-yl)-1,1',6,6',7,7'-hexahydroxy-3,3'-diméthyl-2,2'-binaphtalène-5,5'-dicarboxamide [French] [ACD/IUPAC Name]
N,N'-Di(2,3-dihydro-1H-inden-2-yl)-1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-2,2'-binaphthalene-5,5'-dicarboxamide [ACD/IUPAC Name]
N,N'-Di(2,3-dihydro-1H-inden-2-yl)-1,1',6,6',7,7'-hexahydroxy-3,3'-dimethyl-2,2'-binaphthalin-5,5'-dicarboxamid [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 938.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.2±3.0 kJ/mol
Flash Point: 521.4±34.3 °C
Index of Refraction: 1.825
Molar Refractivity: 194.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 8
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 4
ACD/LogP: 7.38
ACD/LogD (pH 5.5): 6.65
ACD/BCF (pH 5.5): 66495.25
ACD/KOC (pH 5.5): 97501.50
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 13762.03
ACD/KOC (pH 7.4): 20179.16
Polar Surface Area: 180 Å2
Polarizability: 77.2±0.5 10-24cm3
Surface Tension: 103.1±5.0 dyne/cm
Molar Volume: 445.6±5.0 cm3

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