ChemSpider 2D Image | durumolide H | C26H36O9

durumolide H

  • Molecular FormulaC26H36O9
  • Average mass492.559 Da
  • Monoisotopic mass492.235931 Da
  • ChemSpider ID24627485

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(9Z,13Z)-6-(Acetoxymethyl)-6-hydroxy-10,14-dimethyl-3-methylen-2-oxo-2,3,3a,4,5,6,7,8,11,12,15,15a-dodecahydrocyclotetradeca[b]furan-5,15-diyl-diacetat [German] [ACD/IUPAC Name]
(9Z,13Z)-6-(Acetoxymethyl)-6-hydroxy-10,14-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,6,7,8,11,12,15,15a-dodecahydrocyclotetradeca[b]furan-5,15-diyl diacetate [ACD/IUPAC Name]
Cyclotetradeca[b]furan-2(3H)-one, 5,15-bis(acetyloxy)-6-[(acetyloxy)methyl]-3a,4,5,6,7,8,11,12,15,15a-decahydro-6-hydroxy-10,14-dimethyl-3-methylene-, (9Z,13Z)- [ACD/Index Name]
Diacétate de (9Z,13Z)-6-(acétoxyméthyl)-6-hydroxy-10,14-diméthyl-3-méthylène-2-oxo-2,3,3a,4,5,6,7,8,11,12,15,15a-dodécahydrocyclotétradéca[b]furane-5,15-diyle [French] [ACD/IUPAC Name]
durumolide H

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

Density: 1.2±0.1 g/cm3
Boiling Point: 625.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 106.2±6.0 kJ/mol
Flash Point: 201.9±25.0 °C
Index of Refraction: 1.527
Molar Refractivity: 126.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 384.70
ACD/KOC (pH 5.5): 2466.25
ACD/LogD (pH 7.4): 3.70
ACD/BCF (pH 7.4): 384.70
ACD/KOC (pH 7.4): 2466.24
Polar Surface Area: 125 Å2
Polarizability: 50.0±0.5 10-24cm3
Surface Tension: 46.8±5.0 dyne/cm
Molar Volume: 410.2±5.0 cm3

Click to predict properties on the Chemicalize site


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