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

Succinic acid, 2,3-dimethylphenyl isohexyl ester

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InChI
InChI=1S/C18H26O4/c1-13(2)7-6-12-21-17(19)10-11-18(20)22-16-9-5-8-14(3)15(16)4/h5,8-9,13H,6-7,10-12H2,1-4H3
InChI Key
VHLANOOFCYNUCM-UHFFFAOYSA-N
Formula
C18H26O4
SMILES
Cc1cccc(OC(=O)CCC(=O)OCCCC(C)C)c1C
Molecular Weight1
306.40
Sources

Physical Properties

Property Value Unit Source
Δf -276.45 kJ/mol Joback Calculated Property
Δfgas -696.14 kJ/mol Joback Calculated Property
Δfus 37.69 kJ/mol Joback Calculated Property
Δvap 77.19 kJ/mol Joback Calculated Property
logPoct/wat 3.97 Crippen Calculated Property
Pc 1543.92 kPa Joback Calculated Property
Tboil 800.02 K Joback Calculated Property
Tc 1002.86 K Joback Calculated Property
Tfus 473.40 K Joback Calculated Property
Vc 0.98 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 761.07 J/mol×K 800.02 Joback Calculated Property
η 0.00 Pa×s 800.02 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 3
=C< (ring) 3
-CH2- 5
-CH3 4

Similar Compounds

Succinic acid, butyl 2,3-dimethylphenyl ester. Succinic acid, 2,3-dimethylphenyl octyl ester. Succinic acid, 2,3-dimethylphenyl octadecyl ester. Succinic acid, 2,3-dimethylphenyl dodecyl ester. Succinic acid, 2,3-dimethylphenyl nonyl ester. Succinic acid, 2,3-dimethylphenyl pentadecyl ester. Succinic acid, 2,3-dimethylphenyl tridecyl ester. Succinic acid, 2,3-dimethylphenyl hexadecyl ester. Succinic acid, 2,3-dimethylphenyl undecyl ester. Succinic acid, 2,3-dimethylphenyl heptyl ester. Succinic acid, 2,3-dimethylphenyl heptadecyl ester. Succinic acid, 2,3-dimethylphenyl tetradecyl ester. Succinic acid, 2,3-dimethylphenyl propyl ester. Succinic acid, 2,3-dimethylphenyl isobutyl ester. Succinic acid, 8-chlorooctyl 2,3-dimethylphenyl ester.

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