Chemical Properties of 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecanoic acid, methyl ester

4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecanoic acid, methyl ester

InChI
InChI=1S/C12H7F17O2/c1-31-4(30)2-3-5(13,14)6(15,16)7(17,18)8(19,20)9(21,22)10(23,24)11(25,26)12(27,28)29/h2-3H2,1H3
InChI Key
CZMPFGNWUIUUEE-UHFFFAOYSA-N
Formula
C12H7F17O2
SMILES
COC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
506.16
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Physical Properties

Property Value Unit Source
ω 0.6883 Relay (1.0) Calculated Property
ΔfusH° 24.25 kJ/mol Joback Calculated Property
ΔvapH° 70.42 kJ/mol Relay (1.0) Calculated Property
IE 10.67 eV Relay (1.0) Calculated Property
log10WS -7.38 Relay (1.0) Calculated Property
logPoct/wat 5.949 Crippen Calculated Property
McVol 217.470 ml/mol McGowan Calculated Property
Pc 1127.59 kPa Joback Calculated Property
Inp [1019.70; 1019.70]   Show Hide
Inp 1019.70 NIST
Inp 1019.70 NIST
Tboil 475.04 K Relay (1.0) Calculated Property
Tc 610.95 K Relay (1.0) Calculated Property
Tfus 291.16 K Relay (1.0) Calculated Property
Vc 0.903 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation 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 [404.08; 778.47] 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-7.48480e+01
Coefficient B2.29602e+00
Coefficient C-2.18760e-03
Coefficient D7.44900e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 404.08 J/mol×K 273.00 Calculated Property
Cp,gas 496.62 J/mol×K 353.78 Calculated Property
Cp,gas 570.92 J/mol×K 434.56 Calculated Property
Cp,gas 629.35 J/mol×K 515.33 Calculated Property
Cp,gas 674.26 J/mol×K 596.11 Calculated Property
Cp,gas 708.01 J/mol×K 676.89 Calculated Property
Cp,gas 732.95 J/mol×K 757.67 Calculated Property
Cp,gas 751.44 J/mol×K 838.44 Calculated Property
Cp,gas 765.82 J/mol×K 919.22 Calculated Property
Cp,gas 778.47 J/mol×K 1000.00 Calculated Property

Similar Compounds

4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecanoic acid. Dodecanoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. Nonanoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester. Sebacic acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentyl ester. Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl heptadecyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl octyl ester. Sebacic acid, hexyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, nonyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl undecyl ester. Sebacic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester. Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester. Sebacic acid, hexadecyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Find more compounds similar to 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecanoic acid, methyl ester.

Sources

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