ChemSpider 2D Image | 5-Hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-(2,4,6-trihydroxy-3-isobutyrylphenyl)propyl]-4-cyclohexene-1,3-dione | C24H32O7

5-Hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-(2,4,6-trihydroxy-3-isobutyrylphenyl)propyl]-4-cyclohexene-1,3-dione

  • Molecular FormulaC24H32O7
  • Average mass432.507 Da
  • Monoisotopic mass432.214813 Da
  • ChemSpider ID29814103

More details:

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

4-Cyclohexene-1,3-dione, 5-hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-[2,4,6-trihydroxy-3-(2-methyl-1-oxopropyl)phenyl]propyl]- [ACD/Index Name]
5-Hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-(2,4,6-trihydroxy-3-isobutyrylphenyl)propyl]-4-cyclohexen-1,3-dion [German] [ACD/IUPAC Name]
5-Hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-(2,4,6-trihydroxy-3-isobutyrylphenyl)propyl]-4-cyclohexene-1,3-dione [ACD/IUPAC Name]
5-Hydroxy-2,2,6,6-tétraméthyl-4-[2-méthyl-1-(2,4,6-trihydroxy-3-isobutyrylphényl)propyl]-4-cyclohexène-1,3-dione [French] [ACD/IUPAC Name]
2,2,6,6-Tetramethyl-5-hydroxy-4-(α-isopropyl-2,4,6-trihydroxy-3-isobutyrylbenzyl)-4-cyclohexene-1,3-dione
5-hydroxy-2,2,6,6-tetramethyl-4-[2-methyl-1-[2,4,6-trihydroxy-3-(2-methylpropanoyl)phenyl]propyl]cyclohex-4-ene-1,3-dione
Compound NP-007750

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

Density: 1.2±0.1 g/cm3
Boiling Point: 587.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 323.2±26.6 °C
Index of Refraction: 1.572
Molar Refractivity: 115.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 3.91
ACD/BCF (pH 5.5): 309.72
ACD/KOC (pH 5.5): 1062.76
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 2.02
ACD/KOC (pH 7.4): 6.92
Polar Surface Area: 132 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 351.7±3.0 cm3

Click to predict properties on the Chemicalize site


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