ChemSpider 2D Image | Dimethyl (2,2,2-trichloro-1-{[(1E)-1-hydroxy-1-buten-1-yl]oxy}ethyl)phosphonate | C8H14Cl3O5P

Dimethyl (2,2,2-trichloro-1-{[(1E)-1-hydroxy-1-buten-1-yl]oxy}ethyl)phosphonate

  • Molecular FormulaC8H14Cl3O5P
  • Average mass327.526 Da
  • Monoisotopic mass325.964447 Da
  • ChemSpider ID95742203

More details:

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

(2,2,2-Trichloro-1-{[(1E)-1-hydroxy-1-butén-1-yl]oxy}éthyl)phosphonate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl (2,2,2-trichloro-1-{[(1E)-1-hydroxy-1-buten-1-yl]oxy}ethyl)phosphonate [ACD/IUPAC Name]
Dimethyl-(2,2,2-trichlor-1-{[(1E)-1-hydroxy-1-buten-1-yl]oxy}ethyl)phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[2,2,2-trichloro-1-[[(1E)-1-hydroxy-1-buten-1-yl]oxy]ethyl]-, dimethyl ester [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: 378.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.5±6.0 kJ/mol
Flash Point: 182.9±27.9 °C
Index of Refraction: 1.497
Molar Refractivity: 67.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.82
ACD/KOC (pH 5.5): 459.86
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.43
ACD/KOC (pH 7.4): 454.95
Polar Surface Area: 75 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 229.3±3.0 cm3

Click to predict properties on the Chemicalize site


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