ChemSpider 2D Image | 4,4'-[(2,2'-Dihydroxy-1,1'-binaphthalene-3,3'-diyl)dicarbonyl]dibenzonitrile | C36H20N2O4

4,4'-[(2,2'-Dihydroxy-1,1'-binaphthalene-3,3'-diyl)dicarbonyl]dibenzonitrile

  • Molecular FormulaC36H20N2O4
  • Average mass544.555 Da
  • Monoisotopic mass544.142334 Da
  • ChemSpider ID9061352

More details:

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

4,4'-[(2,2'-Dihydroxy-1,1'-binaphtalène-3,3'-diyl)dicarbonyl]dibenzonitrile [French] [ACD/IUPAC Name]
4,4'-[(2,2'-Dihydroxy-1,1'-binaphthalene-3,3'-diyl)dicarbonyl]dibenzonitrile [ACD/IUPAC Name]
4,4'-[(2,2'-Dihydroxy-1,1'-binaphthalin-3,3'-diyl)dicarbonyl]dibenzonitril [German] [ACD/IUPAC Name]
Benzonitrile, 4,4'-[(2,2'-dihydroxy[1,1'-binaphthalene]-3,3'-diyl)dicarbonyl]bis- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 759.9±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: 413.4±32.9 °C
Index of Refraction: 1.791
Molar Refractivity: 157.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 6.97
ACD/BCF (pH 5.5): 115830.70
ACD/KOC (pH 5.5): 143935.47
ACD/LogD (pH 7.4): 6.12
ACD/BCF (pH 7.4): 16325.82
ACD/KOC (pH 7.4): 20287.06
Polar Surface Area: 122 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 90.5±5.0 dyne/cm
Molar Volume: 372.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement