Chemical Properties of Isophthalic acid, 3,3-dimethylbut-2-yl dodecyl ester

Isophthalic acid, 3,3-dimethylbut-2-yl dodecyl ester

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InChI
InChI=1S/C26H42O4/c1-6-7-8-9-10-11-12-13-14-15-19-29-24(27)22-17-16-18-23(20-22)25(28)30-21(2)26(3,4)5/h16-18,20-21H,6-15,19H2,1-5H3
InChI Key
KJOGNTRKUYZRCC-UHFFFAOYSA-N
Formula
C26H42O4
SMILES
CCCCCCCCCCCCOC(=O)c1cccc(C(=O)OC(C)C(C)(C)C)c1
Molecular Weight1
418.61
Sources

Physical Properties

Property Value Unit Source
Δf -196.62 kJ/mol Joback Calculated Property
Δfgas -858.54 kJ/mol Joback Calculated Property
Δfus 51.38 kJ/mol Joback Calculated Property
Δvap 93.04 kJ/mol Joback Calculated Property
logPoct/wat 7.36 Crippen Calculated Property
Pc 930.07 kPa Joback Calculated Property
Tboil 974.85 K Joback Calculated Property
Tc 1193.64 K Joback Calculated Property
Tfus 553.46 K Joback Calculated Property
Vc 1.41 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1243.96 J/mol×K 974.85 Joback Calculated Property
η 0.00 Pa×s 974.85 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 11
>C< 1
-CH3 5

Similar Compounds

Isophthalic acid, 3,3-dimethylbut-2-yl octyl ester. Isophthalic acid, decyl 3,3-dimethylbut-2-yl ester. Isophthalic acid, 3,3-dimethylbut-2-yl pentadecyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl tetradecyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl hexadecyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl tridecyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl nonyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl undecyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl heptyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl hexyl ester. Isophthalic acid, 3-methylbut-2-yl octyl ester. Isophthalic acid, 3-methylbut-2-yl nonyl ester. Isophthalic acid, 3,3-dimethylbut-2-yl isohexyl ester. Isophthalic acid, heptyl 3-methylbut-2-yl ester. Isophthalic acid, hexyl 3-methylbut-2-yl ester.

Find more compounds similar to Isophthalic acid, 3,3-dimethylbut-2-yl dodecyl ester.

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