ChemSpider 2D Image | (6aR,12aS)-6a,12a-Dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromene | C18H12O5

(6aR,12aS)-6a,12a-Dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromene

  • Molecular FormulaC18H12O5
  • Average mass308.285 Da
  • Monoisotopic mass308.068481 Da
  • ChemSpider ID67164016

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6aR,12aS)-6a,12a-Dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromen [German] [ACD/IUPAC Name]
(6aR,12aS)-6a,12a-Dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromene [ACD/IUPAC Name]
(6aR,12aS)-6a,12a-Dihydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromène [French] [ACD/IUPAC Name]
6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c]furo[3,2-g][1]benzopyran, 6a,12a-dihydro-, (6aR,12aS)- [ACD/Index Name]
NEODULIN

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

Density: 1.5±0.1 g/cm3
Boiling Point: 424.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.3±3.0 kJ/mol
Flash Point: 225.6±17.7 °C
Index of Refraction: 1.691
Molar Refractivity: 80.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.79
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 285.40
ACD/KOC (pH 5.5): 1991.69
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 285.40
ACD/KOC (pH 7.4): 1991.69
Polar Surface Area: 50 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 210.5±3.0 cm3

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