Chemical Properties of Dimethylmalonic acid, isohexyl pentafluorophenyl ester

Dimethylmalonic acid, isohexyl pentafluorophenyl ester

InChI
InChI=1S/C17H19F5O4/c1-8(2)6-5-7-25-15(23)17(3,4)16(24)26-14-12(21)10(19)9(18)11(20)13(14)22/h8H,5-7H2,1-4H3
InChI Key
KRLAYCLHTKNNET-UHFFFAOYSA-N
Formula
C17H19F5O4
SMILES
CC(C)CCCOC(=O)C(C)(C)C(=O)Oc1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
382.32
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Physical Properties

Property Value Unit Source
Δfus 41.92 kJ/mol Joback Calculated Property
logPoct/wat 4.293 Crippen Calculated Property
McVol 250.360 ml/mol McGowan Calculated Property
Inp [1720.00; 1720.00]   Show Hide
Inp 1720.00 NIST
Inp 1720.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [741.46; 807.68] J/mol×K [785.20; 972.14] Show Hide
Cp,gas 741.46 J/mol×K 785.20 Joback Calculated Property
Cp,gas 754.58 J/mol×K 816.36 Joback Calculated Property
Cp,gas 766.86 J/mol×K 847.51 Joback Calculated Property
Cp,gas 778.29 J/mol×K 878.67 Joback Calculated Property
Cp,gas 788.90 J/mol×K 909.82 Joback Calculated Property
Cp,gas 798.69 J/mol×K 940.98 Joback Calculated Property
Cp,gas 807.68 J/mol×K 972.14 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, pentafluorophenyl pentyl ester. Dimethylmalonic acid, hexyl pentafluorophenyl ester. Dimethylmalonic acid, pentafluorophenyl tetradecyl ester. Dimethylmalonic acid, heptadecyl pentafluorophenyl ester. Dimethylmalonic acid, hexadecyl pentafluorophenyl ester. Dimethylmalonic acid, heptyl pentafluorophenyl ester. Dimethylmalonic acid, nonyl pentafluorophenyl ester. Dimethylmalonic acid, dodecyl pentafluorophenyl ester. Dimethylmalonic acid, octyl pentafluorophenyl ester. Dimethylmalonic acid, pentafluorophenyl tridecyl ester. Dimethylmalonic acid, decyl pentafluorophenyl ester. Dimethylmalonic acid, pentadecyl pentafluorophenyl ester. Dimethylmalonic acid, octadecyl pentafluorophenyl ester. Dimethylmalonic acid, pentafluorophenyl undecyl ester. Diethylmalonic acid, pentafluorophenyl pentyl ester.

Find more compounds similar to Dimethylmalonic acid, isohexyl pentafluorophenyl ester.

Sources

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