ChemSpider 2D Image | 8,10,14,23,25,28-Hexahydroxy-6,21-dimethoxyoctacyclo[14.11.1.0~2,11~.0~2,15~.0~4,9~.0~13,17~.0~17,26~.0~19,24~]octacosa-4,6,8,10,19,21,23,25-octaene-3,12,18,27-tetrone | C30H22O12

8,10,14,23,25,28-Hexahydroxy-6,21-dimethoxyoctacyclo[14.11.1.02,11.02,15.04,9.013,17.017,26.019,24]octacosa-4,6,8,10,19,21,23,25-octaene-3,12,18,27-tetrone

  • Molecular FormulaC30H22O12
  • Average mass574.489 Da
  • Monoisotopic mass574.111145 Da
  • ChemSpider ID4401646

More details:

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

8,10,14,23,25,28-Hexahydroxy-6,21-dimethoxyoctacyclo[14.11.1.02,11.02,15.04,9.013,17.017,26.019,24]octacosa-4,6,8,10,19,21,23,25-octaen-3,12,18,27-tetron [German] [ACD/IUPAC Name]
8,10,14,23,25,28-Hexahydroxy-6,21-dimethoxyoctacyclo[14.11.1.02,11.02,15.04,9.013,17.017,26.019,24]octacosa-4,6,8,10,19,21,23,25-octaene-3,12,18,27-tetrone [ACD/IUPAC Name]
8,10,14,23,25,28-Hexahydroxy-6,21-diméthoxyoctacyclo[14.11.1.02,11.02,15.04,9.013,17.017,26.019,24]octacosa-4,6,8,10,19,21,23,25-octaène-3,12,18,27-tétrone [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 1028.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 157.5±3.0 kJ/mol
Flash Point: 346.1±27.8 °C
Index of Refraction: 1.852
Molar Refractivity: 134.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 4
ACD/LogP: 5.95
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 31.29
ACD/KOC (pH 5.5): 139.52
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 208 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 130.1±5.0 dyne/cm
Molar Volume: 300.6±5.0 cm3

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