ChemSpider 2D Image | 3,5,5b,7,9-Pentahydroxy-2,11a-bis(4-hydroxyphenyl)-5b,11a-dihydro-4H,6H-chromeno[6',7':4,5]furo[2,3-b]chromene-4,6-dione | C30H18O12

3,5,5b,7,9-Pentahydroxy-2,11a-bis(4-hydroxyphenyl)-5b,11a-dihydro-4H,6H-chromeno[6',7':4,5]furo[2,3-b]chromene-4,6-dione

  • Molecular FormulaC30H18O12
  • Average mass570.457 Da
  • Monoisotopic mass570.079834 Da
  • ChemSpider ID84455224

More details:

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

3,5,5b,7,9-Pentahydroxy-2,11a-bis(4-hydroxyphenyl)-5b,11a-dihydro-4H,6H-chromeno[6',7':4,5]furo[2,3-b]chromen-4,6-dion [German] [ACD/IUPAC Name]
3,5,5b,7,9-Pentahydroxy-2,11a-bis(4-hydroxyphenyl)-5b,11a-dihydro-4H,6H-chromeno[6',7':4,5]furo[2,3-b]chromene-4,6-dione [ACD/IUPAC Name]
3,5,5b,7,9-Pentahydroxy-2,11a-bis(4-hydroxyphényl)-5b,11a-dihydro-4H,6H-chroméno[6',7':4,5]furo[2,3-b]chromène-4,6-dione [French] [ACD/IUPAC Name]
4H,6H-Pyrano[3',2':5,6]benzofuro[2,3-b][1]benzopyran-4,6-dione, 5b,11a-dihydro-3,5,5b,7,9-pentahydroxy-2,11a-bis(4-hydroxyphenyl)- [ACD/Index Name]
1,3,6,17,19-Pentahydroxy-7,13-bis(4-hydroxyphenyl)-8,12,14-trioxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-2(11),3,6,9,15,17,19-heptaene-5,21-dione
Compound NP-022859

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

Density: 1.9±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: 145.8±3.0 kJ/mol
Flash Point: 322.7±27.8 °C
Index of Refraction: 1.870
Molar Refractivity: 139.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 4
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 337.74
ACD/KOC (pH 5.5): 1679.53
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 1.31
ACD/KOC (pH 7.4): 6.49
Polar Surface Area: 203 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 124.6±3.0 dyne/cm
Molar Volume: 306.5±3.0 cm3

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