Found 1 result

Search term: 27023722 (Found by CSID)
ChemSpider 2D Image | 5,7-Dihydroxy-6-[3-hydroxy-2-(hydroxymethyl)-5-methylphenoxy]-4-methyl-2-benzofuran-1(3H)-one | C17H16O7

5,7-Dihydroxy-6-[3-hydroxy-2-(hydroxymethyl)-5-methylphenoxy]-4-methyl-2-benzofuran-1(3H)-one

  • Molecular FormulaC17H16O7
  • Average mass332.305 Da
  • Monoisotopic mass332.089600 Da
  • ChemSpider ID27023722

More details:

Featured data source
Natural Product Updates

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

1(3H)-Isobenzofuranone, 5,7-dihydroxy-6-[3-hydroxy-2-(hydroxymethyl)-5-methylphenoxy]-4-methyl- [ACD/Index Name]
5,7-Dihydroxy-6-[3-hydroxy-2-(hydroxymethyl)-5-methylphenoxy]-4-methyl-2-benzofuran-1(3H)-on [German] [ACD/IUPAC Name]
5,7-Dihydroxy-6-[3-hydroxy-2-(hydroxymethyl)-5-methylphenoxy]-4-methyl-2-benzofuran-1(3H)-one [ACD/IUPAC Name]
5,7-Dihydroxy-6-[3-hydroxy-2-(hydroxyméthyl)-5-méthylphénoxy]-4-méthyl-2-benzofuran-1(3H)-one [French] [ACD/IUPAC Name]
phomopside A

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

Density: 1.5±0.1 g/cm3
Boiling Point: 611.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.5±3.0 kJ/mol
Flash Point: 228.0±25.0 °C
Index of Refraction: 1.693
Molar Refractivity: 83.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.59
ACD/KOC (pH 5.5): 312.27
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 9.12
ACD/KOC (pH 7.4): 131.91
Polar Surface Area: 116 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 77.6±3.0 dyne/cm
Molar Volume: 218.3±3.0 cm3

Click to predict properties on the Chemicalize site


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