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

4-Methylpentan-2-yl 2,3,4,5,6-pentafluorobenzoate

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InChI
InChI=1S/C13H13F5O2/c1-5(2)4-6(3)20-13(19)7-8(14)10(16)12(18)11(17)9(7)15/h5-6H,4H2,1-3H3
InChI Key
LSAKNAZPUHYCEQ-UHFFFAOYSA-N
Formula
C13H13F5O2
SMILES
CC(C)CC(C)OC(=O)c1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
296.23
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Physical Properties

Property Value Unit Source
Δf -1090.01 kJ/mol Joback Calculated Property
Δfgas -1368.38 kJ/mol Joback Calculated Property
Δfus 32.66 kJ/mol Joback Calculated Property
Δvap 54.41 kJ/mol Joback Calculated Property
log10WS -5.34 Crippen Calculated Property
logPoct/wat 3.974 Crippen Calculated Property
McVol 186.560 ml/mol McGowan Calculated Property
Pc 1775.84 kPa Joback Calculated Property
Inp 1318.00 NIST
Tboil 620.18 K Joback Calculated Property
Tc 795.32 K Joback Calculated Property
Tfus 370.40 K Joback Calculated Property
Vc 0.757 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [482.63; 548.31] J/mol×K [620.18; 795.32] Show Hide
Cp,gas 482.63 J/mol×K 620.18 Joback Calculated Property
Cp,gas 494.95 J/mol×K 649.37 Joback Calculated Property
Cp,gas 506.72 J/mol×K 678.56 Joback Calculated Property
Cp,gas 517.94 J/mol×K 707.75 Joback Calculated Property
Cp,gas 528.61 J/mol×K 736.94 Joback Calculated Property
Cp,gas 538.73 J/mol×K 766.13 Joback Calculated Property
Cp,gas 548.31 J/mol×K 795.32 Joback Calculated Property

Similar Compounds

Pentafluorobenzoic acid, 2-pentyl ester. Octan-2-yl 2,3,4,5,6-pentafluorobenzoate. Decan-2-yl 2,3,4,5,6-pentafluorobenzoate. Pentafluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,4-Dimethylpentan-3-yl 2,3,4,5,6-pentafluorobenzoate. Pentafluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 3-Methylbutan-2-yl 2,3,4,5,6-pentafluorobenzoate. Isopentyl 2,3,4,5,6-pentafluorobenzoate. 3,7-Dimethyloct-6-enyl 2,3,4,5,6-pentafluorobenzoate. Pentafluorobenzoic acid, 2-methylpentyl ester. Pentafluorobenzoic acid, 2-butyl ester. Pentafluorobenzoic acid, 4-methoxy-2-methylbutyl ester. Pentafluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 2,3,4-Trifluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. Benzoic acid, 4-methylpent-2-yl ester.

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

Sources

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