ChemSpider 2D Image | Ethyl (2E)-2-(ethoxymethylene)-4,4-difluoro-3-oxobutanoate | C9H12F2O4

Ethyl (2E)-2-(ethoxymethylene)-4,4-difluoro-3-oxobutanoate

  • Molecular FormulaC9H12F2O4
  • Average mass222.186 Da
  • Monoisotopic mass222.070358 Da
  • ChemSpider ID21469451
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-2-(Éthoxyméthylène)-4,4-difluoro-3-oxobutanoate d'éthyle [French] [ACD/IUPAC Name]
Butanoic acid, 2-(ethoxymethylene)-4,4-difluoro-3-oxo-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-2-(ethoxymethylene)-4,4-difluoro-3-oxobutanoate [ACD/IUPAC Name]
Ethyl-(2E)-2-(ethoxymethylen)-4,4-difluor-3-oxobutanoat [German] [ACD/IUPAC Name]
ethyl (2E)-2-(2,2-difluoroacetyl)-3-ethoxyprop-2-enoate
Ethyl 2-(ethoxymethylene)-4,4-difluoro(acetoacetate)
ethyl 2-(ethoxymethylidene)-4,4-difluoro-3-oxobutanoate
Ethyl 4,4-difluoro-2-(ethoxymethylene)-3-oxobutanoate
ethyl(2E)-2-(ethoxymethylene)-4,4-difluoro-3-oxo-butanoate
Ethyl2-(ethoxymethylene)-4,4-difluoro-3-oxobutanoate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 248.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 101.1±22.2 °C
Index of Refraction: 1.417
Molar Refractivity: 47.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.40
ACD/KOC (pH 5.5): 131.43
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.40
ACD/KOC (pH 7.4): 131.43
Polar Surface Area: 53 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 29.4±3.0 dyne/cm
Molar Volume: 188.7±3.0 cm3

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