Chemical Properties of Pentadecafluorooctanoic acid, oct-3-en-2-yl ester

Pentadecafluorooctanoic acid, oct-3-en-2-yl ester

InChI
InChI=1S/C16H15F15O2/c1-3-4-5-6-7-8(2)33-9(32)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)31/h6-8H,3-5H2,1-2H3/b7-6+
InChI Key
YTNCTWJYJGADOP-VOTSOKGWSA-N
Formula
C16H15F15O2
SMILES
CCCC/C=C/C(C)OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
524.26
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Physical Properties

Property Value Unit Source
ΔfusH° 32.55 kJ/mol Joback Calculated Property
logPoct/wat 7.039 Crippen Calculated Property
McVol 265.990 ml/mol McGowan Calculated Property
Inp [1215.00; 1215.00]   Show Hide
Inp 1215.00 NIST
Inp 1215.00 NIST
Tboil 486.01 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 [459.68; 939.18] 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-8.20570e+01
Coefficient B2.55254e+00
Coefficient C-2.28760e-03
Coefficient D7.56300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 459.68 J/mol×K 273.00 Calculated Property
Cp,gas 568.15 J/mol×K 353.78 Calculated Property
Cp,gas 657.24 J/mol×K 434.56 Calculated Property
Cp,gas 729.34 J/mol×K 515.33 Calculated Property
Cp,gas 786.85 J/mol×K 596.11 Calculated Property
Cp,gas 832.16 J/mol×K 676.89 Calculated Property
Cp,gas 867.65 J/mol×K 757.67 Calculated Property
Cp,gas 895.72 J/mol×K 838.44 Calculated Property
Cp,gas 918.77 J/mol×K 919.22 Calculated Property
Cp,gas 939.18 J/mol×K 1000.00 Calculated Property

Similar Compounds

Pentadecafluorooctanoic acid, dodec-2-en-1-yl ester. Pentadecafluorooctanoic acid, undec-2-en-1-yl ester. Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl oct-3-en-2-yl ester. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl oct-3-en-2-yl ester. trans-2-Dodecen-1-ol, heptafluorobutyrate. trans-2-Decen-1-ol, heptafluorobutyrate. Succinic acid, 2,2,3,3-tetrafluoropropyl oct-3-en-2-yl ester. Glutaric acid, 2,2,3,3-tetrafluoropropyl oct-3-en-2-yl ester. cis-3-Nonen-1-ol, heptafluorobutyrate. Glutaric acid, 1,1,1-trifluoroprop-2-yl oct-3-en-2-yl ester. Butyric acid, 4-phenyl-, oct-3-en-2-yl ester. Cyclopropanecarboxylic acid, oct-3-en-2-yl ester. Butanoic acid, oct-3-en-2-yl ester. Sebacic acid, butyl oct-3-en-2-yl ester. Glutaric acid, 3-methylbut-2-en-1-yl oct-3-en-2-yl ester.

Find more compounds similar to Pentadecafluorooctanoic acid, oct-3-en-2-yl ester.

Sources

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