ChemSpider 2D Image | (3-Hydroxy-1,2-dimethyl-6-oxocyclohexyl)(5-hydroxy-4-methyl-2-oxo-2,5-dihydro-3-furanyl)methyl (2Z)-2-methyl-2-butenoate | C19H26O7

(3-Hydroxy-1,2-dimethyl-6-oxocyclohexyl)(5-hydroxy-4-methyl-2-oxo-2,5-dihydro-3-furanyl)methyl (2Z)-2-methyl-2-butenoate

  • Molecular FormulaC19H26O7
  • Average mass366.405 Da
  • Monoisotopic mass366.167847 Da
  • ChemSpider ID35015158

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-Méthyl-2-buténoate de (3-hydroxy-1,2-diméthyl-6-oxocyclohexyl)(5-hydroxy-4-méthyl-2-oxo-2,5-dihydro-3-furanyl)méthyle [French] [ACD/IUPAC Name]
(3-Hydroxy-1,2-dimethyl-6-oxocyclohexyl)(5-hydroxy-4-methyl-2-oxo-2,5-dihydro-3-furanyl)methyl (2Z)-2-methyl-2-butenoate [ACD/IUPAC Name]
(3-Hydroxy-1,2-dimethyl-6-oxocyclohexyl)(5-hydroxy-4-methyl-2-oxo-2,5-dihydro-3-furanyl)methyl-(2Z)-2-methyl-2-butenoat [German] [ACD/IUPAC Name]
2-Butenoic acid, 2-methyl-, (2,5-dihydro-5-hydroxy-4-methyl-2-oxo-3-furanyl)(3-hydroxy-1,2-dimethyl-6-oxocyclohexyl)methyl ester, (2Z)- [ACD/Index Name]
(3-hydroxy-1,2-dimethyl-6-oxocyclohexyl)(5-hydroxy-4-methyl-2-oxo-5H-furan-3-yl)methyl (2Z)-2-methylbut-2-enoate
Secoeremopetasitolide A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 569.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.2±6.0 kJ/mol
Flash Point: 200.5±23.6 °C
Index of Refraction: 1.544
Molar Refractivity: 92.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.52
ACD/KOC (pH 5.5): 133.19
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.49
ACD/KOC (pH 7.4): 132.59
Polar Surface Area: 110 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 292.0±3.0 cm3

Click to predict properties on the Chemicalize site


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