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Search term: 27026151 (Found by CSID)
ChemSpider 2D Image | 1-(11-Hydroxy-1-methoxy-9-methyl-5-oxo-5H,7H-dibenzo[b,g][1,5]dioxocin-2-yl)-3-methylbutyl acetate | C23H26O7

1-(11-Hydroxy-1-methoxy-9-methyl-5-oxo-5H,7H-dibenzo[b,g][1,5]dioxocin-2-yl)-3-methylbutyl acetate

  • Molecular FormulaC23H26O7
  • Average mass414.448 Da
  • Monoisotopic mass414.167847 Da
  • ChemSpider ID27026151

More details:

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

1-(11-Hydroxy-1-methoxy-9-methyl-5-oxo-5H,7H-dibenzo[b,g][1,5]dioxocin-2-yl)-3-methylbutyl acetate [ACD/IUPAC Name]
1-(11-Hydroxy-1-methoxy-9-methyl-5-oxo-5H,7H-dibenzo[b,g][1,5]dioxocin-2-yl)-3-methylbutyl-acetat [German] [ACD/IUPAC Name]
5H,7H-Dibenzo[b,g][1,5]dioxocin-5-one, 2-[1-(acetyloxy)-3-methylbutyl]-11-hydroxy-1-methoxy-9-methyl- [ACD/Index Name]
Acétate de 1-(11-hydroxy-1-méthoxy-9-méthyl-5-oxo-5H,7H-dibenzo[b,g][1,5]dioxocin-2-yl)-3-méthylbutyle [French] [ACD/IUPAC Name]
paeciloxocin B

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

Density: 1.2±0.1 g/cm3
Boiling Point: 601.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 206.2±25.0 °C
Index of Refraction: 1.560
Molar Refractivity: 109.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 416.21
ACD/KOC (pH 5.5): 2608.64
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 393.38
ACD/KOC (pH 7.4): 2465.57
Polar Surface Area: 91 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 338.8±3.0 cm3

Click to predict properties on the Chemicalize site


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