ChemSpider 2D Image | (7Z,10Z)-6-Hydroxy-10-(hydroxymethyl)-6-methyl-3-methylene-2,9-dioxo-2,3,3a,4,5,6,9,11a-octahydrocyclodeca[b]furan-4-yl 2-methylbutanoate | C20H26O7

(7Z,10Z)-6-Hydroxy-10-(hydroxymethyl)-6-methyl-3-methylene-2,9-dioxo-2,3,3a,4,5,6,9,11a-octahydrocyclodeca[b]furan-4-yl 2-methylbutanoate

  • Molecular FormulaC20H26O7
  • Average mass378.416 Da
  • Monoisotopic mass378.167847 Da
  • ChemSpider ID35015074

  • Double-bond stereo - Double-bond stereo

More details:

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

(7Z,10Z)-6-Hydroxy-10-(hydroxymethyl)-6-methyl-3-methylen-2,9-dioxo-2,3,3a,4,5,6,9,11a-octahydrocyclodeca[b]furan-4-yl-2-methylbutanoat [German] [ACD/IUPAC Name]
(7Z,10Z)-6-Hydroxy-10-(hydroxymethyl)-6-methyl-3-methylene-2,9-dioxo-2,3,3a,4,5,6,9,11a-octahydrocyclodeca[b]furan-4-yl 2-methylbutanoate [ACD/IUPAC Name]
2-Méthylbutanoate de (7Z,10Z)-6-hydroxy-10-(hydroxyméthyl)-6-méthyl-3-méthylène-2,9-dioxo-2,3,3a,4,5,6,9,11a-octahydrocyclodéca[b]furan-4-yle [French] [ACD/IUPAC Name]
Butanoic acid, 2-methyl-, (7Z,10Z)-2,3,3a,4,5,6,9,11a-octahydro-6-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylene-2,9-dioxocyclodeca[b]furan-4-yl ester [ACD/Index Name]
(1E,4Z,6a,8b,10a)-8-(2-Methylbutanoyloxy)-10,15-dihydroxy-3-oxo-1,4,11(13)-germacratrien-12,6-olide
6-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylidene-2,9-dioxo-3aH,4H,5H,11aH-cyclodeca[b]furan-4-yl 2-methylbutanoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 593.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.5±6.0 kJ/mol
Flash Point: 207.8±23.6 °C
Index of Refraction: 1.552
Molar Refractivity: 96.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.23
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 8.56
ACD/KOC (pH 5.5): 161.79
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 8.56
ACD/KOC (pH 7.4): 161.79
Polar Surface Area: 110 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 51.1±5.0 dyne/cm
Molar Volume: 302.1±5.0 cm3

Click to predict properties on the Chemicalize site


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