ChemSpider 2D Image | 6-(2,4,6-Trichlorophenoxy)hexanoic acid | C12H13Cl3O3

6-(2,4,6-Trichlorophenoxy)hexanoic acid

  • Molecular FormulaC12H13Cl3O3
  • Average mass311.589 Da
  • Monoisotopic mass309.993042 Da
  • ChemSpider ID44447266

More details:

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

6-(2,4,6-Trichlorophenoxy)hexanoic acid [ACD/IUPAC Name]
6-(2,4,6-Trichlorphenoxy)hexansäure [German] [ACD/IUPAC Name]
Acide 6-(2,4,6-trichlorophénoxy)hexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 6-(2,4,6-trichlorophenoxy)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 447.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 224.4±28.7 °C
Index of Refraction: 1.552
Molar Refractivity: 72.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 174.35
ACD/KOC (pH 5.5): 808.77
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 2.77
ACD/KOC (pH 7.4): 12.86
Polar Surface Area: 47 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 226.4±3.0 cm3

Click to predict properties on the Chemicalize site


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