ChemSpider 2D Image | skyrin | C30H18O10

skyrin

  • Molecular FormulaC30H18O10
  • Average mass538.458 Da
  • Monoisotopic mass538.090027 Da
  • ChemSpider ID65863

More details:

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

[1,1'-Bianthracene]-9,9',10,10'-tetrone, 2,2',4,4',5,5'-hexahydroxy-7,7'-dimethyl- [ACD/Index Name]
2,2',4,4',5,5'-Hexahydroxy-7,7'-dimethyl-1,1'-bianthracen-9,9',10,10'-tetron [German] [ACD/IUPAC Name]
2,2',4,4',5,5'-Hexahydroxy-7,7'-dimethyl-1,1'-bianthracene-9,9',10,10'-tetrone [ACD/IUPAC Name]
2,2',4,4',5,5'-Hexahydroxy-7,7'-diméthyl-1,1'-bianthracène-9,9',10,10'-tétrone [French] [ACD/IUPAC Name]
602-06-2 [RN]
skyrin
UNII:VLA1F42GXP
VLA1F42GXP
(−)-R-skyrin
(+)-S-Skyrin
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4401 [DBID]
NCI60_003292 [DBID]
NSC 361128 [DBID]
NSC361128 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 956.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.0±3.0 kJ/mol
Flash Point: 545.8±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: 8.91
ACD/LogD (pH 5.5): 6.20
ACD/BCF (pH 5.5): 17106.59
ACD/KOC (pH 5.5): 18813.49
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
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

Click to predict properties on the Chemicalize site


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