Chemical Properties of Succinic acid, 1-(2,6-difluorophenyl)ethyl isobutyl ester

Succinic acid, 1-(2,6-difluorophenyl)ethyl isobutyl ester

InChI
InChI=1S/C16H20F2O4/c1-10(2)9-21-14(19)7-8-15(20)22-11(3)16-12(17)5-4-6-13(16)18/h4-6,10-11H,7-9H2,1-3H3
InChI Key
UVEKJCXLQQOMPH-UHFFFAOYSA-N
Formula
C16H20F2O4
SMILES
CC(C)COC(=O)CCC(=O)OC(C)c1c(F)cccc1F
Molecular Weight1
314.32
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Physical Properties

Property Value Unit Source
ΔfH°gas -1147.70 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 38.31 kJ/mol Joback Calculated Property
ΔvapH° 86.82 kJ/mol Relay (1.0) Calculated Property
log10WS -4.13 Relay (1.0) Calculated Property
logPoct/wat 3.548 Crippen Calculated Property
McVol 230.960 ml/mol McGowan Calculated Property
Pc 1578.46 kPa Joback Calculated Property
Inp [1886.00; 1886.00]   Show Hide
Inp 1886.00 NIST
Inp 1886.00 NIST
Tboil 572.07 K Relay (1.0) Calculated Property
Tc 765.32 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [653.44; 727.65] J/mol×K [716.42; 907.27] Show Hide
Cp,gas 653.44 J/mol×K 716.42 Joback Calculated Property
Cp,gas 668.21 J/mol×K 748.23 Joback Calculated Property
Cp,gas 682.00 J/mol×K 780.04 Joback Calculated Property
Cp,gas 694.83 J/mol×K 811.84 Joback Calculated Property
Cp,gas 706.71 J/mol×K 843.65 Joback Calculated Property
Cp,gas 717.65 J/mol×K 875.46 Joback Calculated Property
Cp,gas 727.65 J/mol×K 907.27 Joback Calculated Property

Similar Compounds

Succinic acid, 1-(2,6-difluorophenyl)ethyl propyl ester. Glutaric acid, 1-(2,6-difluorophenyl)ethyl isobutyl ester. Succinic acid, butyl 1-(2,6-difluorophenyl)ethyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl ethyl ester. Succinic acid, 1-(2-fluorophenyl)ethyl isobutyl ester. Succinic acid, di(1-(2,6-difluorophenyl)ethyl) ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl pentyl ester. Glutaric acid, 1-(2,6-difluorophenyl)ethyl propyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl nonyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl undecyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl heptyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl hexyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl tetradecyl ester. Succinic acid, 1-(2,6-difluorophenyl)ethyl octyl ester. Succinic acid, decyl 1-(2,6-difluorophenyl)ethyl ester.

Find more compounds similar to Succinic acid, 1-(2,6-difluorophenyl)ethyl isobutyl ester.

Sources

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