Chemical Properties of 3-Pentafluoropropionyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-

3-Pentafluoropropionyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-

InChI
InChI=1S/C15H8F12O5/c1-30-7-3-2-6(4-8(7)32-10(29)12(18,19)14(22,23)24)5-31-9(28)11(16,17)13(20,21)15(25,26)27/h2-4H,5H2,1H3
InChI Key
NIKNBIGAMDVOGQ-UHFFFAOYSA-N
Formula
C15H8F12O5
SMILES
COc1ccc(COC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1OC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
496.20
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Physical Properties

Property Value Unit Source
ΔfusH° 37.68 kJ/mol Joback Calculated Property
logPoct/wat 4.674 Crippen Calculated Property
McVol 240.440 ml/mol McGowan Calculated Property
Inp [1403.00; 1403.00]   Show Hide
Inp 1403.00 NIST
Inp 1403.00 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [717.89; 769.88] J/mol×K [693.39; 859.92] Show Hide
Cp,gas 717.89 J/mol×K 693.39 Joback Calculated Property
Cp,gas 728.61 J/mol×K 721.15 Joback Calculated Property
Cp,gas 738.44 J/mol×K 748.90 Joback Calculated Property
Cp,gas 747.43 J/mol×K 776.66 Joback Calculated Property
Cp,gas 755.63 J/mol×K 804.41 Joback Calculated Property
Cp,gas 763.10 J/mol×K 832.17 Joback Calculated Property
Cp,gas 769.88 J/mol×K 859.92 Joback Calculated Property

Similar Compounds

3-Hydroxy-4-methoxybenzyl alcohol, di(heptafluorobutyrate). 3-Heptafluorobutyryloxy-4-methoxybenzyl alcohol, O-pentafluoropropionyl-. 4-Hydroxy-3-methoxybenzyl alcohol, bis(heptafluorobutyrate). 3-trifluoroacetyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-. 3-Hydroxy-4-methoxybenzyl alcohol, di(pentafluoropropionate). 4-Hydroxy-3-methoxybenzyl alcohol, bis(pentafluoropropionate). 3-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). 3,5-Dihydroxybenzyl alcohol, tris(heptafluorobutyrate). 4-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). 3-Hydroxy-4-methoxybenzyl alcohol, di(trifluoroacetate). 2-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). Coniferyl alcohol, bis(heptafluorobutyrate). 4-Hydroxy-3-methoxybenzyl alcohol, bis(trifluoroacetate). 3-Hydroxybenzyl alcohol, bis(pentafluoropropionate). Succinic acid, naphth-2-ylmethyl 2-methoxy-5-methylphenyl ester.

Find more compounds similar to 3-Pentafluoropropionyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-.

Sources

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