ChemSpider 2D Image | 2-[(2R,6aR,12aR)-1,2,6a,12a-Tetrahydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromen-2-yl]-2-propen-1-ol | C21H18O6

2-[(2R,6aR,12aR)-1,2,6a,12a-Tetrahydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromen-2-yl]-2-propen-1-ol

  • Molecular FormulaC21H18O6
  • Average mass366.364 Da
  • Monoisotopic mass366.110352 Da
  • ChemSpider ID25052046

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2-[(2R,6aR,12aR)-1,2,6a,12a-Tetrahydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromen-2-yl]-2-propen-1-ol [German] [ACD/IUPAC Name]
2-[(2R,6aR,12aR)-1,2,6a,12a-Tetrahydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromen-2-yl]-2-propen-1-ol [ACD/IUPAC Name]
2-[(2R,6aR,12aR)-1,2,6a,12a-Tétrahydro-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]furo[3,2-g]chromén-2-yl]-2-propén-1-ol [French] [ACD/IUPAC Name]
6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c]furo[3,2-g][1]benzopyran-2-ethanol, 1,2,6a,12a-tetrahydro-β-methylene-, (2R,6aR,12aR)- [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: 518.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 267.3±30.1 °C
Index of Refraction: 1.658
Molar Refractivity: 94.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 114.30
ACD/KOC (pH 5.5): 1034.57
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 114.30
ACD/KOC (pH 7.4): 1034.57
Polar Surface Area: 66 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 256.7±3.0 cm3

Click to predict properties on the Chemicalize site


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