Chemical Properties of 4-Hydroxyphenethyl alcohol, bis(pentafluoropropionate)

4-Hydroxyphenethyl alcohol, bis(pentafluoropropionate)

InChI
InChI=1S/C14H8F10O4/c15-11(16,13(19,20)21)9(25)27-6-5-7-1-3-8(4-2-7)28-10(26)12(17,18)14(22,23)24/h1-4H,5-6H2
InChI Key
VBEIAWKZVNXVMQ-UHFFFAOYSA-N
Formula
C14H8F10O4
SMILES
O=C(OCCc1ccc(OC(=O)C(F)(F)C(F)(F)F)cc1)C(F)(F)C(F)(F)F
Molecular Weight1
430.19
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Physical Properties

Property Value Unit Source
ΔfusH° 35.55 kJ/mol Joback Calculated Property
logPoct/wat 4.073 Crippen Calculated Property
McVol 216.940 ml/mol McGowan Calculated Property
Inp [1317.00; 1317.00]   Show Hide
Inp 1317.00 NIST
Inp 1317.00 NIST
Tboil 515.45 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 [356.59; 712.83] 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-1.56080e+01
Coefficient B1.70700e+00
Coefficient C-1.36396e-03
Coefficient D3.85400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 356.59 J/mol×K 273.00 Calculated Property
Cp,gas 434.64 J/mol×K 353.78 Calculated Property
Cp,gas 500.24 J/mol×K 434.56 Calculated Property
Cp,gas 554.59 J/mol×K 515.33 Calculated Property
Cp,gas 598.91 J/mol×K 596.11 Calculated Property
Cp,gas 634.43 J/mol×K 676.89 Calculated Property
Cp,gas 662.36 J/mol×K 757.67 Calculated Property
Cp,gas 683.93 J/mol×K 838.44 Calculated Property
Cp,gas 700.35 J/mol×K 919.22 Calculated Property
Cp,gas 712.83 J/mol×K 1000.00 Calculated Property

Similar Compounds

4-Hydroxyphenethyl alcohol, bis(heptafluorobutyrate). 4-Hydroxyphenethyl alcohol, bis(trifluoroacetate). tyrosol acetate. Succinic acid, phenethyl 4-isopropylphenyl ester. Succinic acid, 2-fluorophenyl phenethyl ester. 1-Heptafluorobutyryloxy-2-phenylethane. p-Hydroxyphenyllactic acid, TFA-ME. Succinic acid, phenethyl 3-fluorophenyl ester. Succinic acid, 4-chloro-3-methylphenyl phenethyl ester. Glutaric acid, 2-fluorophenyl phenethyl ester. (S)-p-Hydroxyphenyllactic acid, (S)-(+)-3-methyl-2-butyl ester, O-TFA. (R)-p-Hydroxyphenyllactic acid, (S)-(+)-3-methyl-2-butyl ester, O-TFA. Succinic acid, phenethyl 2,3-dichlorophenyl ester. Succinic acid, phenethyl 2-biphenyl ester. Glutaric acid, 3-chlorophenyl phenethyl ester.

Find more compounds similar to 4-Hydroxyphenethyl alcohol, bis(pentafluoropropionate).

Sources

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