ChemSpider 2D Image | (6aR,12aR)-12a-Hydroxy-2,3,9-trimethoxy-6a,12a-dihydrochromeno[3,4-b]chromen-12(6H)-one | C19H18O7

(6aR,12aR)-12a-Hydroxy-2,3,9-trimethoxy-6a,12a-dihydrochromeno[3,4-b]chromen-12(6H)-one

  • Molecular FormulaC19H18O7
  • Average mass358.342 Da
  • Monoisotopic mass358.105255 Da
  • ChemSpider ID22913420

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6aR,12aR)-12a-Hydroxy-2,3,9-trimethoxy-6a,12a-dihydrochromeno[3,4-b]chromen-12(6H)-on [German] [ACD/IUPAC Name]
(6aR,12aR)-12a-Hydroxy-2,3,9-trimethoxy-6a,12a-dihydrochromeno[3,4-b]chromen-12(6H)-one [ACD/IUPAC Name]
(6aR,12aR)-12a-Hydroxy-2,3,9-triméthoxy-6a,12a-dihydrochroméno[3,4-b]chromén-12(6H)-one [French] [ACD/IUPAC Name]
(6aR,12aR)-6a,12a-Dihydro-12a-hydroxy-2,3,9-trimethoxy[1]benzopyrano[3,4-b][1]benzopyran-12(6H)-one
[1]Benzopyrano[2,3-c][1]benzopyran-12(6H)-one, 6a,12a-dihydro-12a-hydroxy-2,3,9-trimethoxy-, (6aR,12aR)- [ACD/Index Name]
66280-24-8 [RN]
cis-12a-Hydroxymunduserone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 574.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 209.1±23.6 °C
Index of Refraction: 1.612
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 85.48
ACD/KOC (pH 5.5): 840.29
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 85.41
ACD/KOC (pH 7.4): 839.63
Polar Surface Area: 83 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 260.4±3.0 cm3

Click to predict properties on the Chemicalize site


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