ChemSpider 2D Image | thielavin Z5 | C28H28O10

thielavin Z5

  • Molecular FormulaC28H28O10
  • Average mass524.516 Da
  • Monoisotopic mass524.168274 Da
  • ChemSpider ID61708669

More details:

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

4-({4-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]-2-methoxy-3,6-dimethylbenzoyl}oxy)-2-hydroxy-3,5,6-trimethylbenzoesäure [German] [ACD/IUPAC Name]
4-({4-[(2,4-Dihydroxy-6-methylbenzoyl)oxy]-2-methoxy-3,6-dimethylbenzoyl}oxy)-2-hydroxy-3,5,6-trimethylbenzoic acid [ACD/IUPAC Name]
Acide 4-({4-[(2,4-dihydroxy-6-méthylbenzoyl)oxy]-2-méthoxy-3,6-diméthylbenzoyl}oxy)-2-hydroxy-3,5,6-triméthylbenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-methoxy-3,6-dimethyl-, 4-carboxy-3-hydroxy-2,5,6-trimethylphenyl ester [ACD/Index Name]
thielavin Z5

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

Density: 1.4±0.1 g/cm3
Boiling Point: 810.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.5±3.0 kJ/mol
Flash Point: 269.7±27.8 °C
Index of Refraction: 1.633
Molar Refractivity: 137.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 7.97
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 117.94
ACD/KOC (pH 5.5): 137.60
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 50.05
ACD/KOC (pH 7.4): 58.39
Polar Surface Area: 160 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 59.6±3.0 dyne/cm
Molar Volume: 385.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement