ChemSpider 2D Image | arzanol | C22H26O7

arzanol

  • Molecular FormulaC22H26O7
  • Average mass402.438 Da
  • Monoisotopic mass402.167847 Da
  • ChemSpider ID23281706

More details:

Featured data source
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2H-Pyran-2-one, 3-[[3-acetyl-2,4,6-trihydroxy-5-(3-methyl-2-buten-1-yl)phenyl]methyl]-6-ethyl-4-hydroxy-5-methyl- [ACD/Index Name]
3-[[3-Acetyl-2,4,6-trihydroxy-5-(3-methyl-2-buten-1-yl)phenyl]methyl]-6-ethyl-4-hydroxy-5-methyl-2H-pyran-2-one
3-[3-Acetyl-2,4,6-trihydroxy-5-(3-methyl-2-buten-1-yl)benzyl]-6-ethyl-4-hydroxy-5-methyl-2H-pyran-2-on [German] [ACD/IUPAC Name]
3-[3-Acetyl-2,4,6-trihydroxy-5-(3-methyl-2-buten-1-yl)benzyl]-6-ethyl-4-hydroxy-5-methyl-2H-pyran-2-one [ACD/IUPAC Name]
3-[3-Acétyl-2,4,6-trihydroxy-5-(3-méthyl-2-butén-1-yl)benzyl]-6-éthyl-4-hydroxy-5-méthyl-2H-pyran-2-one [French] [ACD/IUPAC Name]
3-[3-acetyl-2,4,6-trihydroxy-5-(3-methylbut-2-en-1-yl)benzyl]-6-ethyl-4-hydroxy-5-methyl-2H-pyran-2-one
32274-52-5 [RN]
arzanol
MFCD28168041
3-[4-Acetyl-2,3,6-trihydroxy-5-(3-methyl-2-butenyl)benzyl]-6-ethyl-4-hydroxy-5-methyl-2H-pyran-2-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 632.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.3±3.0 kJ/mol
Flash Point: 218.9±25.0 °C
Index of Refraction: 1.617
Molar Refractivity: 107.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 4.66
ACD/BCF (pH 5.5): 1801.16
ACD/KOC (pH 5.5): 6346.27
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 43.27
ACD/KOC (pH 7.4): 152.47
Polar Surface Area: 124 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 308.0±3.0 cm3

Click to predict properties on the Chemicalize site


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