ChemSpider 2D Image | 6-Methyl-2-(2,4,5-trichlorophenoxy)heptyl acetate | C16H21Cl3O3

6-Methyl-2-(2,4,5-trichlorophenoxy)heptyl acetate

  • Molecular FormulaC16H21Cl3O3
  • Average mass367.695 Da
  • Monoisotopic mass366.055634 Da
  • ChemSpider ID58807219

More details:

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

1-Heptanol, 6-methyl-2-(2,4,5-trichlorophenoxy)-, acetate [ACD/Index Name]
6-Methyl-2-(2,4,5-trichlorophenoxy)heptyl acetate [ACD/IUPAC Name]
6-Methyl-2-(2,4,5-trichlorphenoxy)heptyl-acetat [German] [ACD/IUPAC Name]
Acétate de 6-méthyl-2-(2,4,5-trichlorophénoxy)heptyle [French] [ACD/IUPAC Name]
25168-15-4 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 413.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 140.7±26.3 °C
Index of Refraction: 1.514
Molar Refractivity: 91.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.30
ACD/LogD (pH 5.5): 6.43
ACD/BCF (pH 5.5): 45386.34
ACD/KOC (pH 5.5): 74991.07
ACD/LogD (pH 7.4): 6.43
ACD/BCF (pH 7.4): 45386.34
ACD/KOC (pH 7.4): 74991.07
Polar Surface Area: 36 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 37.8±3.0 dyne/cm
Molar Volume: 302.1±3.0 cm3

Click to predict properties on the Chemicalize site


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