ChemSpider 2D Image | 4,4',5,5',6,6'-Hexahydroxy-2-(2-hydroxypropyl)-2'-(2-oxopropyl)-8H,8'H-9,9'-bibenzo[g]chromene-8,8'-dione | C32H24O12

4,4',5,5',6,6'-Hexahydroxy-2-(2-hydroxypropyl)-2'-(2-oxopropyl)-8H,8'H-9,9'-bibenzo[g]chromene-8,8'-dione

  • Molecular FormulaC32H24O12
  • Average mass600.526 Da
  • Monoisotopic mass600.126770 Da
  • ChemSpider ID78434633

More details:

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

[9,9'-Bi-8H-naphtho[2,3-b]pyran]-8,8'-dione, 4,4',5,5',6,6'-hexahydroxy-2-(2-hydroxypropyl)-2'-(2-oxopropyl)- [ACD/Index Name]
4,4',5,5',6,6'-Hexahydroxy-2-(2-hydroxypropyl)-2'-(2-oxopropyl)-8H,8'H-9,9'-bibenzo[g]chromen-8,8'-dion [German] [ACD/IUPAC Name]
4,4',5,5',6,6'-Hexahydroxy-2-(2-hydroxypropyl)-2'-(2-oxopropyl)-8H,8'H-9,9'-bibenzo[g]chromene-8,8'-dione [ACD/IUPAC Name]
4,4',5,5',6,6'-Hexahydroxy-2-(2-hydroxypropyl)-2'-(2-oxopropyl)-8H,8'H-9,9'-bibenzo[g]chromène-8,8'-dione [French] [ACD/IUPAC Name]
HYPOCHROMIN A

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

Density: 1.8±0.1 g/cm3
Boiling Point: 655.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 110.6±6.0 kJ/mol
Flash Point: 209.0±25.0 °C
Index of Refraction: 1.817
Molar Refractivity: 147.3±0.4 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: -5.37
ACD/LogD (pH 5.5): -6.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 211 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 107.2±5.0 dyne/cm
Molar Volume: 339.5±5.0 cm3

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