Chemical Properties of Succinic acid, 2,3-dimethylphenyl isobutyl ester

Succinic acid, 2,3-dimethylphenyl isobutyl ester

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InChI
InChI=1S/C16H22O4/c1-11(2)10-19-15(17)8-9-16(18)20-14-7-5-6-12(3)13(14)4/h5-7,11H,8-10H2,1-4H3
InChI Key
LRNXBYPGZPCXKY-UHFFFAOYSA-N
Formula
C16H22O4
SMILES
Cc1cccc(OC(=O)CCC(=O)OCC(C)C)c1C
Molecular Weight1
278.34
Sources

Physical Properties

Property Value Unit Source
Δf -293.29 kJ/mol Joback Calculated Property
Δfgas -654.86 kJ/mol Joback Calculated Property
Δfus 32.51 kJ/mol Joback Calculated Property
Δvap 72.73 kJ/mol Joback Calculated Property
logPoct/wat 3.19 Crippen Calculated Property
Pc 1806.16 kPa Joback Calculated Property
Tboil 754.26 K Joback Calculated Property
Tc 959.78 K Joback Calculated Property
Tfus 450.86 K Joback Calculated Property
Vc 0.87 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 648.19 J/mol×K 754.26 Joback Calculated Property
η 0.00 Pa×s 754.26 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 4
=CH- (ring) 3
=C< (ring) 3
-CH2- 3
>C=O (nonring) 2

Similar Compounds

Succinic acid, 2,3-dimethylphenyl propyl ester. Succinic acid, butyl 2,3-dimethylphenyl ester. Succinic acid, 3-methylbut-2-yl 2,3-dimethylphenyl ester. Succinic acid, 2,3-dimethylphenyl isohexyl ester. Succinic acid, 2,3-dimethylphenyl undecyl ester. Succinic acid, 2,3-dimethylphenyl heptyl ester. Succinic acid, 2,3-dimethylphenyl nonyl ester. Succinic acid, 2,3-dimethylphenyl dodecyl ester. Succinic acid, 2,3-dimethylphenyl octadecyl ester. Succinic acid, 2,3-dimethylphenyl heptadecyl ester. Succinic acid, 2,3-dimethylphenyl octyl ester. Succinic acid, 2,3-dimethylphenyl hexadecyl ester. Succinic acid, 2,3-dimethylphenyl tridecyl ester. Succinic acid, 2,3-dimethylphenyl tetradecyl ester. Succinic acid, 2,3-dimethylphenyl pentadecyl ester.

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