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Search term: 28285213 (Found by CSID)
ChemSpider 2D Image | Ethyl (2-ethyl-10-hydroxy-7-oxo-2,3,4,5,6,7-hexahydro-1-benzoxonin-8-yl)acetate | C18H24O5

Ethyl (2-ethyl-10-hydroxy-7-oxo-2,3,4,5,6,7-hexahydro-1-benzoxonin-8-yl)acetate

  • Molecular FormulaC18H24O5
  • Average mass320.380 Da
  • Monoisotopic mass320.162384 Da
  • ChemSpider ID28285213

More details:

Featured data source
Natural Product Updates

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

(2-Éthyl-10-hydroxy-7-oxo-2,3,4,5,6,7-hexahydro-1-benzoxonin-8-yl)acétate d'éthyle [French] [ACD/IUPAC Name]
1-Benzoxonin-8-acetic acid, 2-ethyl-2,3,4,5,6,7-hexahydro-10-hydroxy-7-oxo-, ethyl ester [ACD/Index Name]
Ethyl (2-ethyl-10-hydroxy-7-oxo-2,3,4,5,6,7-hexahydro-1-benzoxonin-8-yl)acetate [ACD/IUPAC Name]
Ethyl-(2-ethyl-10-hydroxy-7-oxo-2,3,4,5,6,7-hexahydro-1-benzoxonin-8-yl)acetat [German] [ACD/IUPAC Name]
phomopsin A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 487.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 172.5±22.2 °C
Index of Refraction: 1.520
Molar Refractivity: 85.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1210.59
ACD/KOC (pH 5.5): 5600.78
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1098.71
ACD/KOC (pH 7.4): 5083.16
Polar Surface Area: 73 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 282.3±3.0 cm3

Click to predict properties on the Chemicalize site


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