ChemSpider 2D Image | 4-Chloro-6-(2,4-dichloro-3-hydroxy-5-propylphenoxy)-5-propyl-1,3-benzenediol | C18H19Cl3O4

4-Chloro-6-(2,4-dichloro-3-hydroxy-5-propylphenoxy)-5-propyl-1,3-benzenediol

  • Molecular FormulaC18H19Cl3O4
  • Average mass405.700 Da
  • Monoisotopic mass404.034882 Da
  • ChemSpider ID35516939

More details:

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

1,3-Benzenediol, 4-chloro-6-(2,4-dichloro-3-hydroxy-5-propylphenoxy)-5-propyl- [ACD/Index Name]
4-Chlor-6-(2,4-dichlor-3-hydroxy-5-propylphenoxy)-5-propyl-1,3-benzoldiol [German] [ACD/IUPAC Name]
4-Chloro-6-(2,4-dichloro-3-hydroxy-5-propylphenoxy)-5-propyl-1,3-benzenediol [ACD/IUPAC Name]
4-Chloro-6-(2,4-dichloro-3-hydroxy-5-propylphénoxy)-5-propyl-1,3-benzènediol [French] [ACD/IUPAC Name]
Spiromastol A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 480.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 244.5±28.7 °C
Index of Refraction: 1.617
Molar Refractivity: 101.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.85
ACD/LogD (pH 5.5): 6.36
ACD/BCF (pH 5.5): 38753.48
ACD/KOC (pH 5.5): 64407.24
ACD/LogD (pH 7.4): 5.22
ACD/BCF (pH 7.4): 2804.03
ACD/KOC (pH 7.4): 4660.22
Polar Surface Area: 70 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 289.8±3.0 cm3

Click to predict properties on the Chemicalize site


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