Chemical Properties of Dimethylmalonic acid, isohexyl 2,3,4-trifluorophenyl ester

Dimethylmalonic acid, isohexyl 2,3,4-trifluorophenyl ester

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InChI
InChI=1S/C17H21F3O4/c1-10(2)6-5-9-23-15(21)17(3,4)16(22)24-12-8-7-11(18)13(19)14(12)20/h7-8,10H,5-6,9H2,1-4H3
InChI Key
BQGWLJHVUFOEAS-UHFFFAOYSA-N
Formula
C17H21F3O4
SMILES
CC(C)CCCOC(=O)C(C)(C)C(=O)Oc1ccc(F)c(F)c1F
Molecular Weight1
346.34
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Physical Properties

Property Value Unit Source
Δf -876.09 kJ/mol Joback Calculated Property
Δfgas -1284.05 kJ/mol Joback Calculated Property
Δfus 36.54 kJ/mol Joback Calculated Property
Δvap 71.88 kJ/mol Joback Calculated Property
log10WS -4.93 Crippen Calculated Property
logPoct/wat 4.015 Crippen Calculated Property
McVol 246.820 ml/mol McGowan Calculated Property
Pc 1502.31 kPa Joback Calculated Property
Inp [1820.00; 1820.00]   Show Hide
Inp 1820.00 NIST
Inp 1820.00 NIST
Tboil 776.70 K Joback Calculated Property
Tc 970.93 K Joback Calculated Property
Tfus 478.84 K Joback Calculated Property
Vc 0.965 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [728.03; 799.04] J/mol×K [776.70; 970.93] Show Hide
Cp,gas 728.03 J/mol×K 776.70 Joback Calculated Property
Cp,gas 742.14 J/mol×K 809.07 Joback Calculated Property
Cp,gas 755.31 J/mol×K 841.44 Joback Calculated Property
Cp,gas 767.57 J/mol×K 873.81 Joback Calculated Property
Cp,gas 778.93 J/mol×K 906.18 Joback Calculated Property
Cp,gas 789.41 J/mol×K 938.55 Joback Calculated Property
Cp,gas 799.04 J/mol×K 970.93 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, pentyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, hexyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, hexadecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, tetradecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, octyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, 2,3,4-trifluorophenyl undecyl ester. Dimethylmalonic acid, octadecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, pentadecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, decyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, nonyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, tridecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, dodecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, heptadecyl 2,3,4-trifluorophenyl ester. Dimethylmalonic acid, butyl 2,3,4-trifluorophenyl ester. Diethylmalonic acid, pentyl 2,3,4-trifluorophenyl ester.

Find more compounds similar to Dimethylmalonic acid, isohexyl 2,3,4-trifluorophenyl ester.

Sources

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