ChemSpider 2D Image | 1',4',6',7'-Tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-1,4,6,7-tetrone | C28H26O8

1',4',6',7'-Tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-1,4,6,7-tetrone

  • Molecular FormulaC28H26O8
  • Average mass490.501 Da
  • Monoisotopic mass490.162781 Da
  • ChemSpider ID107560901

More details:

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

[2,2'-Binaphthalene]-1,4,6,7-tetrone, 1',4',6',7'-tetrahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)- [ACD/Index Name]
1',4',6',7'-Tétrahydroxy-5,5'-diisopropyl-3,3'-diméthyl-2,2'-binaphtalène-1,4,6,7-tétrone [French] [ACD/IUPAC Name]
1',4',6',7'-Tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-1,4,6,7-tetrone [ACD/IUPAC Name]
1',4',6',7'-Tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalin-1,4,6,7-tetron [German] [ACD/IUPAC Name]
886578-07-0 [RN]
Apogossypolone

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

Density: 1.5±0.1 g/cm3
Boiling Point: 735.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.1±3.0 kJ/mol
Flash Point: 412.7±29.4 °C
Index of Refraction: 1.698
Molar Refractivity: 128.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 791.88
ACD/KOC (pH 5.5): 4134.47
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 772.20
ACD/KOC (pH 7.4): 4031.76
Polar Surface Area: 149 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 77.1±5.0 dyne/cm
Molar Volume: 333.7±5.0 cm3

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