ChemSpider 2D Image | 1',3,6,6',7,7'-Hexahydroxy-5',8-diisopropyl-1,3'-dimethyl-2,2'-binaphthalene-5,8'-dicarbaldehyde | C30H30O8

1',3,6,6',7,7'-Hexahydroxy-5',8-diisopropyl-1,3'-dimethyl-2,2'-binaphthalene-5,8'-dicarbaldehyde

  • Molecular FormulaC30H30O8
  • Average mass518.554 Da
  • Monoisotopic mass518.194092 Da
  • ChemSpider ID24785087

More details:

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

[2,2'-Binaphthalene]-5,8'-dicarboxaldehyde, 1',3,6,6',7,7'-hexahydroxy-1,3'-dimethyl-5',8-bis(1-methylethyl)- [ACD/Index Name]
1',3,6,6',7,7'-Hexahydroxy-5',8-diisopropyl-1,3'-diméthyl-2,2'-binaphtalène-5,8'-dicarbaldéhyde [French] [ACD/IUPAC Name]
1',3,6,6',7,7'-Hexahydroxy-5',8-diisopropyl-1,3'-dimethyl-2,2'-binaphthalene-5,8'-dicarbaldehyde [ACD/IUPAC Name]
1',3,6,6',7,7'-Hexahydroxy-5',8-diisopropyl-1,3'-dimethyl-2,2'-binaphthalin-5,8'-dicarbaldehyd [German] [ACD/IUPAC Name]
Gossypol [Wiki]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 709.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.4±3.0 kJ/mol
Flash Point: 396.7±28.0 °C
Index of Refraction: 1.742
Molar Refractivity: 149.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 5.74
ACD/BCF (pH 5.5): 13373.84
ACD/KOC (pH 5.5): 31064.02
ACD/LogD (pH 7.4): 5.22
ACD/BCF (pH 7.4): 4044.01
ACD/KOC (pH 7.4): 9393.20
Polar Surface Area: 156 Å2
Polarizability: 59.2±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 369.6±3.0 cm3

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