ChemSpider 2D Image | Iridoskyrin | C30H18O10

Iridoskyrin

  • Molecular FormulaC30H18O10
  • Average mass538.458 Da
  • Monoisotopic mass538.090027 Da
  • ChemSpider ID4528453

More details:






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

Iridoskyrin
(1,1'-Bianthracene)-9,9',10,10'-tetrone, 4,4',5,5',8,8'-hexahydroxy-7,7'-dimethyl-
[1,1'-Bianthracene]-9,9',10,10'-tetrone, 4,4',5,5',8,8'-hexahydroxy-7,7'-dimethyl- [ACD/Index Name]
1,1'-Bianthraquinone, 4,4',5,5',8,8'-hexahydroxy-7,7'-dimethyl-
4,4',5,5',8,8'-Hexahydroxy-7,7'-dimethyl-1,1'-bianthracen-9,9',10,10'-tetron [German] [ACD/IUPAC Name]
4,4',5,5',8,8'-Hexahydroxy-7,7'-dimethyl-1,1'-bianthracene-9,9',10,10'-tetrone [ACD/IUPAC Name]
4,4',5,5',8,8'-Hexahydroxy-7,7'-diméthyl-1,1'-bianthracène-9,9',10,10'-tétrone [French] [ACD/IUPAC Name]
568-42-3 [RN]
8AZV3YYO98
4,4',5,5',8,8'-HEXAHYDROXY-7,7'-DIMETHYL-[1,1'-BIANTHRACENE]-9,9',10,10'-TETRONE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 3477 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 912.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 137.2±3.0 kJ/mol
Flash Point: 519.4±30.8 °C
Index of Refraction: 1.808
Molar Refractivity: 136.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 4
ACD/LogP: 10.49
ACD/LogD (pH 5.5): 8.16
ACD/BCF (pH 5.5): 739627.94
ACD/KOC (pH 5.5): 416266.47
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 370.14
ACD/KOC (pH 7.4): 208.32
Polar Surface Area: 190 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 100.6±3.0 dyne/cm
Molar Volume: 317.1±3.0 cm3

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