Found 1 result

Search term: JEZFFKVMFCDTRK-SESIOFODSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | (1R,4S,8R,9S,10R,13R,14S)-8-Hydroxy-5,5,9,14-tetramethyl-7,15-dioxapentacyclo[11.3.1.0~1,10~.0~4,9~.0~14,16~]heptadecan-6-one | C19H28O4

(1R,4S,8R,9S,10R,13R,14S)-8-Hydroxy-5,5,9,14-tetramethyl-7,15-dioxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecan-6-one

  • Molecular FormulaC19H28O4
  • Average mass320.423 Da
  • Monoisotopic mass320.198761 Da
  • ChemSpider ID128920837
  • defined stereocentres - 7 of 8 defined stereocentres


More details:






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

(1R,4S,8R,9S,10R,13R,14S)-8-Hydroxy-5,5,9,14-tetramethyl-7,15-dioxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecan-6-on [German] [ACD/IUPAC Name]
(1R,4S,8R,9S,10R,13R,14S)-8-Hydroxy-5,5,9,14-tetramethyl-7,15-dioxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecan-6-one [ACD/IUPAC Name]
(1R,4S,8R,9S,10R,13R,14S)-8-Hydroxy-5,5,9,14-tétraméthyl-7,15-dioxapentacyclo[11.3.1.01,10.04,9.014,16]heptadécan-6-one [French] [ACD/IUPAC Name]
2H-7,8b-Methanooxireno[6,7]cyclohepta[1,2-h][2]benzopyran-2-one, dodecahydro-4-hydroxy-1,1,4a,7a-tetramethyl-, (4R,4aS,4bR,7R,7aS,8bR,10aS)- [ACD/Index Name]
Oryzalide A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 469.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 84.3±6.0 kJ/mol
Flash Point: 166.4±22.2 °C
Index of Refraction: 1.570
Molar Refractivity: 84.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.26
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.50
ACD/KOC (pH 5.5): 258.85
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.50
ACD/KOC (pH 7.4): 258.85
Polar Surface Area: 59 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 258.6±5.0 cm3

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