Chemical Properties of Diethylmalonic acid, monochloride, 2,2,3,3,4,4,4-heptafluorobutyl ester

Diethylmalonic acid, monochloride, 2,2,3,3,4,4,4-heptafluorobutyl ester

InChI
InChI=1S/C11H12ClF7O3/c1-3-8(4-2,6(12)20)7(21)22-5-9(13,14)10(15,16)11(17,18)19/h3-5H2,1-2H3
InChI Key
QATJCKBVCHBRPL-UHFFFAOYSA-N
Formula
C11H12ClF7O3
SMILES
CCC(CC)(C(=O)Cl)C(=O)OCC(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
360.65
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Physical Properties

Property Value Unit Source
ΔfusH° 26.32 kJ/mol Joback Calculated Property
logPoct/wat 3.934 Crippen Calculated Property
McVol 199.490 ml/mol McGowan Calculated Property
Inp [1142.00; 1142.00]   Show Hide
Inp 1142.00 NIST
Inp 1142.00 NIST
Tboil 467.90 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [321.05; 647.59] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.67070e+01
Coefficient B1.55864e+00
Coefficient C-1.28370e-03
Coefficient D3.89360e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 321.05 J/mol×K 273.00 Calculated Property
Cp,gas 391.28 J/mol×K 353.78 Calculated Property
Cp,gas 450.15 J/mol×K 434.56 Calculated Property
Cp,gas 498.89 J/mol×K 515.33 Calculated Property
Cp,gas 538.73 J/mol×K 596.11 Calculated Property
Cp,gas 570.91 J/mol×K 676.89 Calculated Property
Cp,gas 596.65 J/mol×K 757.67 Calculated Property
Cp,gas 617.19 J/mol×K 838.44 Calculated Property
Cp,gas 633.76 J/mol×K 919.22 Calculated Property
Cp,gas 647.59 J/mol×K 1000.00 Calculated Property

Similar Compounds

Diethylmalonic acid, monochloride, 2,2,3,3,4,4,5,5-octafluoropentyl ester. Diethylmalonic acid, di(2,2,3,3,4,4,4-heptafluorobutyl) ester. Diethylmalonic acid, ethyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl propyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl isobutyl ester. Diethylmalonic acid, butyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl pentyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexyl ester. Diethylmalonic acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl undecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl tetradecyl ester. Diethylmalonic acid, dodecyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl heptyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl pentadecyl ester.

Find more compounds similar to Diethylmalonic acid, monochloride, 2,2,3,3,4,4,4-heptafluorobutyl ester.

Sources

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