ChemSpider 2D Image | (6aR,11aS)-6a,11a-Dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol | C15H12O4

(6aR,11aS)-6a,11a-Dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol

  • Molecular FormulaC15H12O4
  • Average mass256.253 Da
  • Monoisotopic mass256.073547 Da
  • ChemSpider ID113610807

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6aR,11aS)-6a,11a-Dihydro-6H-[1]benzofuro[3,2-c]chromen-3,9-diol [German] [ACD/IUPAC Name]
(6aR,11aS)-6a,11a-Dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol [ACD/IUPAC Name]
(6aR,11aS)-6a,11a-Dihydro-6H-[1]benzofuro[3,2-c]chromène-3,9-diol [French] [ACD/IUPAC Name]
6H-Benzofuro[3,2-c][1]benzopyran-3,9-diol, 6a,11a-dihydro-, (6aR,11aS)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 450.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 226.3±28.7 °C
Index of Refraction: 1.684
Molar Refractivity: 68.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.61
ACD/KOC (pH 5.5): 710.41
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 66.71
ACD/KOC (pH 7.4): 700.99
Polar Surface Area: 59 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 68.0±3.0 dyne/cm
Molar Volume: 179.3±3.0 cm3

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