Chemical Properties of 1-Butoxypropan-2-yl 2,3,4,5,6-pentafluorobenzoate

1-Butoxypropan-2-yl 2,3,4,5,6-pentafluorobenzoate

InChI
InChI=1S/C14H15F5O3/c1-3-4-5-21-6-7(2)22-14(20)8-9(15)11(17)13(19)12(18)10(8)16/h7H,3-6H2,1-2H3
InChI Key
HIPHBAOSIJPGCZ-UHFFFAOYSA-N
Formula
C14H15F5O3
SMILES
CCCCOCC(C)OC(=O)c1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
326.26
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Physical Properties

Property Value Unit Source
ΔfusH° 39.96 kJ/mol Joback Calculated Property
IE 9.58 eV Relay (1.0) Calculated Property
logPoct/wat 3.744 Crippen Calculated Property
McVol 206.520 ml/mol McGowan Calculated Property
Inp [1521.00; 1521.00]   Show Hide
Inp 1521.00 NIST
Inp 1521.00 NIST
Tboil 532.61 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, 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 [559.19; 626.40] J/mol×K [665.92; 838.18] Show Hide
Cp,gas 559.19 J/mol×K 665.92 Joback Calculated Property
Cp,gas 571.85 J/mol×K 694.63 Joback Calculated Property
Cp,gas 583.94 J/mol×K 723.34 Joback Calculated Property
Cp,gas 595.44 J/mol×K 752.05 Joback Calculated Property
Cp,gas 606.35 J/mol×K 780.76 Joback Calculated Property
Cp,gas 616.67 J/mol×K 809.47 Joback Calculated Property
Cp,gas 626.40 J/mol×K 838.18 Joback Calculated Property

Similar Compounds

1-((1-Butoxypropan-2-yl)oxy)propan-2-yl 2,3,4,5,6-pentafluorobenzoate. 1-Propoxypropan-2-yl 2,3,4,5,6-pentafluorobenzoate. 2-Butoxyethyl 2,3,4,5,6-pentafluorobenzoate. 2-(2-Butoxyethoxy)ethyl 2,3,4,5,6-pentafluorobenzoate. 2-(2-(2-Butoxyethoxy)ethoxy)ethyl 2,3,4,5,6-pentafluorobenzoate. 1-((1-Methoxypropan-2-yl)oxy)propan-2-yl 2,3,4,5,6-pentafluorobenzoate. 1-(tert-Butoxy)propan-2-yl 2,3,4,5,6-pentafluorobenzoate. 1-Butoxypropan-2-yl 4-chlorobenzoate. 1-Butoxypropan-2-yl 3,5-dinitrobenzoate. 1-Butoxypropan-2-yl 2-chlorobenzoate. Pentafluorobenzoic acid, 2-pentyl ester. Pentafluorobenzoic acid, 4-methoxy-2-methylbutyl ester. Diglycolic acid, butyl pentafluorobenzyl ester. 1-(2,2-Dimethyl-1,3-dioxolan-4-yl)-2-methoxy-2-oxoethyl 2,3,4,5,6-pentafluorobenzoate. Diglycolic acid, hexyl pentafluorobenzyl ester.

Find more compounds similar to 1-Butoxypropan-2-yl 2,3,4,5,6-pentafluorobenzoate.

Sources

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