Chemical Properties of 3-Hydroxybenzyl alcohol, bis(pentafluoropropionate)

3-Hydroxybenzyl alcohol, bis(pentafluoropropionate)

InChI
InChI=1S/C13H6F10O4/c14-10(15,12(18,19)20)8(24)26-5-6-2-1-3-7(4-6)27-9(25)11(16,17)13(21,22)23/h1-4H,5H2
InChI Key
WLTANTDSDDCSPD-UHFFFAOYSA-N
Formula
C13H6F10O4
SMILES
O=C(OCc1cccc(OC(=O)C(F)(F)C(F)(F)F)c1)C(F)(F)C(F)(F)F
Molecular Weight1
416.17
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Physical Properties

Property Value Unit Source
ΔfusH° 32.96 kJ/mol Joback Calculated Property
logPoct/wat 4.030 Crippen Calculated Property
McVol 202.850 ml/mol McGowan Calculated Property
Inp 1190.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 [335.38; 661.24] 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-1.46990e+01
Coefficient B1.61200e+00
Coefficient C-1.30956e-03
Coefficient D3.73500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 335.38 J/mol×K 273.00 Calculated Property
Cp,gas 408.23 J/mol×K 353.78 Calculated Property
Cp,gas 469.16 J/mol×K 434.56 Calculated Property
Cp,gas 519.36 J/mol×K 515.33 Calculated Property
Cp,gas 560.00 J/mol×K 596.11 Calculated Property
Cp,gas 592.27 J/mol×K 676.89 Calculated Property
Cp,gas 617.35 J/mol×K 757.67 Calculated Property
Cp,gas 636.41 J/mol×K 838.44 Calculated Property
Cp,gas 650.65 J/mol×K 919.22 Calculated Property
Cp,gas 661.24 J/mol×K 1000.00 Calculated Property

Similar Compounds

3,5-Dihydroxybenzyl alcohol, tris(pentafluoropropionate). 3-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). 4-Hydroxybenzyl alcohol, bis(pentafluoropropionate). 3-Hydroxy-4-methoxybenzyl alcohol, di(pentafluoropropionate). 3-Hydroxybenzyl alcohol, bis(trifluoroacetate). 4-Hydroxy-3-methoxybenzyl alcohol, bis(pentafluoropropionate). 3,5-Dihydroxybenzyl alcohol, tris(heptafluorobutyrate). 2-Hydroxybenzyl alcohol, bis(pentafluoropropionate). 3-Heptafluorobutyryloxy-4-methoxybenzyl alcohol, O-pentafluoropropionyl-. 3-Pentafluoropropionyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-. 3-Hydroxy-4-methoxybenzyl alcohol, di(heptafluorobutyrate). 4-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). 4-Hydroxy-3-methoxybenzyl alcohol, bis(heptafluorobutyrate). 2-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). 3-trifluoroacetyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-.

Find more compounds similar to 3-Hydroxybenzyl alcohol, bis(pentafluoropropionate).

Sources

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