ChemSpider 2D Image | (1Z,4S,8S,10Z,13R,16S)-16-Hydroxy-4-isopropenyl-8-methoxy-11-methyl-14-oxabicyclo[11.2.1]hexadeca-1,10-diene-6,9,15-trione | C20H26O6

(1Z,4S,8S,10Z,13R,16S)-16-Hydroxy-4-isopropenyl-8-methoxy-11-methyl-14-oxabicyclo[11.2.1]hexadeca-1,10-diene-6,9,15-trione

  • Molecular FormulaC20H26O6
  • Average mass362.417 Da
  • Monoisotopic mass362.172943 Da
  • ChemSpider ID40256860

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1Z,4S,8S,10Z,13R,16S)-16-Hydroxy-4-isopropenyl-8-methoxy-11-methyl-14-oxabicyclo[11.2.1]hexadeca-1,10-dien-6,9,15-trion [German] [ACD/IUPAC Name]
(1Z,4S,8S,10Z,13R,16S)-16-Hydroxy-4-isopropenyl-8-methoxy-11-methyl-14-oxabicyclo[11.2.1]hexadeca-1,10-diene-6,9,15-trione [ACD/IUPAC Name]
(1Z,4S,8S,10Z,13R,16S)-16-Hydroxy-4-isopropényl-8-méthoxy-11-méthyl-14-oxabicyclo[11.2.1]hexadéca-1,10-diène-6,9,15-trione [French] [ACD/IUPAC Name]
14-Oxabicyclo[11.2.1]hexadeca-1,10-diene-6,9,15-trione, 16-hydroxy-8-methoxy-11-methyl-4-(1-methylethenyl)-, (1Z,4S,8S,10Z,13R,16S)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 607.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.5±6.0 kJ/mol
Flash Point: 214.6±25.0 °C
Index of Refraction: 1.535
Molar Refractivity: 94.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.23
ACD/KOC (pH 5.5): 97.68
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.23
ACD/KOC (pH 7.4): 97.68
Polar Surface Area: 90 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 304.2±5.0 cm3

Click to predict properties on the Chemicalize site


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