ChemSpider 2D Image | 2-Methoxymethyl salvinorin B | C23H30O8

2-Methoxymethyl salvinorin B

  • Molecular FormulaC23H30O8
  • Average mass434.479 Da
  • Monoisotopic mass434.194061 Da
  • ChemSpider ID23323947
  • defined stereocentres - 7 of 7 defined stereocentres


More details:






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

(2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-Furyl)-9-(méthoxyméthoxy)-6a,10b-diméthyl-4,10-dioxododécahydro-2H-benzo[f]isochromène-7-carboxylate de méthyle [French] [ACD/IUPAC Name]
2H-Naphtho[2,1-c]pyran-7-carboxylic acid, 2-(3-furanyl)dodecahydro-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxo-, methyl ester, (2S,4aR,6aR,7R,9S,10aS,10bR)- [ACD/Index Name]
2-Methoxymethyl salvinorin B [Wiki]
Methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furyl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxododecahydro-2H-benzo[f]isochromene-7-carboxylate [ACD/IUPAC Name]
methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxododecahydro-2H-benzo[f]isochromene-7-carboxylate
Methyl-(2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furyl)-9-(methoxymethoxy)-6a,10b-dimethyl-4,10-dioxododecahydro-2H-benzo[f]isochromen-7-carboxylat [German] [ACD/IUPAC Name]
864378-87-0 [RN]
salvinorin B methoxymethyl ether

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 557.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 290.8±30.1 °C
Index of Refraction: 1.540
Molar Refractivity: 108.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 25.94
ACD/KOC (pH 5.5): 357.91
ACD/LogD (pH 7.4): 2.16
ACD/BCF (pH 7.4): 25.94
ACD/KOC (pH 7.4): 357.91
Polar Surface Area: 101 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 48.6±5.0 dyne/cm
Molar Volume: 345.1±5.0 cm3

Click to predict properties on the Chemicalize site





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