ChemSpider 2D Image | 8,8'-Dicyano-6,6',7,7'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-1,1'-diyl diacetate | C34H32N2O8

8,8'-Dicyano-6,6',7,7'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-1,1'-diyl diacetate

  • Molecular FormulaC34H32N2O8
  • Average mass596.627 Da
  • Monoisotopic mass596.215881 Da
  • ChemSpider ID109361

More details:






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

(2,2'-binaphthalene)-8,8'-dicarbonitrile, 1,1'-bis(acetyloxy)-6,6',7,7'-tetrahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-
[2,2'-Binaphthalene]-8,8'-dicarbonitrile, 1,1'-bis(acetyloxy)-6,6',7,7'-tetrahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)- [ACD/Index Name]
8,8'-Dicyan-6,6',7,7'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalin-1,1'-diyl-diacetat [German] [ACD/IUPAC Name]
8,8'-Dicyano-6,6',7,7'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-1,1'-diyl diacetate [ACD/IUPAC Name]
Diacétate de 8,8'-dicyano-6,6',7,7'-tétrahydroxy-5,5'-diisopropyl-3,3'-diméthyl-2,2'-binaphtalène-1,1'-diyle [French] [ACD/IUPAC Name]
6,6',7,7'-Tetrahydroxy-3,3'-dimethyl-2,2'-diacetoxy-5,5'-bis(1-methylethyl)-[2,2'-binaphthalene]-, 8,8'-dicarbonitrile
94242-60-1 [RN]
99780-73-1 [RN]
Acetic acid 1'-acetoxy-8,8'-dicyano-6,7,6',7'-tetrahydroxy-5,5'-diisopropyl-3,3'-dimethyl-[2,2']binaphthalenyl-1-yl ester
GN-1,1-DA
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS003522 [DBID]
AIDS-003522 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 793.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.4±3.0 kJ/mol
Flash Point: 433.5±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 161.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 7.85
ACD/LogD (pH 5.5): 6.22
ACD/BCF (pH 5.5): 28678.39
ACD/KOC (pH 5.5): 48575.70
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 161.77
ACD/KOC (pH 7.4): 274.01
Polar Surface Area: 181 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 80.3±5.0 dyne/cm
Molar Volume: 421.1±5.0 cm3

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