ChemSpider 2D Image | 2-(4-Chloro-2-methylphenoxy)-4-ethyloctanoic acid | C17H25ClO3

2-(4-Chloro-2-methylphenoxy)-4-ethyloctanoic acid

  • Molecular FormulaC17H25ClO3
  • Average mass312.832 Da
  • Monoisotopic mass312.149231 Da
  • ChemSpider ID24751361

More details:






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

2-(4-Chlor-2-methylphenoxy)-4-ethyloctansäure [German] [ACD/IUPAC Name]
2-(4-Chloro-2-methylphenoxy)-4-ethyloctanoic acid [ACD/IUPAC Name]
Acide 2-(4-chloro-2-méthylphénoxy)-4-éthyloctanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 2-(4-chloro-2-methylphenoxy)-4-ethyl- [ACD/Index Name]
2-ethylhexyl(4-chloro-2-methylphenoxy)acetate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 420.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 208.1±24.6 °C
Index of Refraction: 1.513
Molar Refractivity: 85.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 64.00
ACD/KOC (pH 5.5): 145.84
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 3.38
ACD/KOC (pH 7.4): 7.70
Polar Surface Area: 47 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 285.6±3.0 cm3

Click to predict properties on the Chemicalize site






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