Chemical Properties of Isophthalic acid, isohexyl 2-isopropylphenyl ester

Isophthalic acid, isohexyl 2-isopropylphenyl ester

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InChI
InChI=1S/C23H28O4/c1-16(2)9-8-14-26-22(24)18-10-7-11-19(15-18)23(25)27-21-13-6-5-12-20(21)17(3)4/h5-7,10-13,15-17H,8-9,14H2,1-4H3
InChI Key
YYYIYIINSDMEGK-UHFFFAOYSA-N
Formula
C23H28O4
SMILES
CC(C)CCCOC(=O)c1cccc(C(=O)Oc2ccccc2C(C)C)c1
Molecular Weight1
368.47
Sources

Physical Properties

Property Value Unit Source
Δf -124.38 kJ/mol Joback Calculated Property
Δfgas -568.09 kJ/mol Joback Calculated Property
Δfus 41.16 kJ/mol Joback Calculated Property
Δvap 90.20 kJ/mol Joback Calculated Property
logPoct/wat 5.62 Crippen Calculated Property
Pc 1386.08 kPa Joback Calculated Property
Tboil 940.66 K Joback Calculated Property
Tc 1167.15 K Joback Calculated Property
Tfus 541.17 K Joback Calculated Property
Vc 1.14 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 956.88 J/mol×K 940.66 Joback Calculated Property
η 0.00 Pa×s 940.66 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 8
=C< (ring) 4
-CH2- 3
-CH3 4

Similar Compounds

Isophthalic acid, 2-isopropylphenyl pentyl ester. Isophthalic acid, hexyl 2-isopropylphenyl ester. Isophthalic acid, decyl 2-isopropylphenyl ester. Isophthalic acid, heptyl 2-isopropylphenyl ester. Isophthalic acid, 2-isopropylphenyl octyl ester. Isophthalic acid, 2-isopropylphenyl undecyl ester. Isophthalic acid, dodecyl 2-isopropylphenyl ester. Isophthalic acid, butyl 2-isopropylphenyl ester. Isophthalic acid, 2-isopropylphenyl propyl ester. Isophthalic acid, isobutyl 2-isopropylphenyl ester. Isophthalic acid, 2-ethylphenyl pentyl ester. Isophthalic acid, 2-ethylphenyl hexyl ester. Isophthalic acid, ethyl 2-isopropylphenyl ester. Isophthalic acid, 2-ethylphenyl heptyl ester. Isophthalic acid, 2-ethylphenyl octyl ester.

Find more compounds similar to Isophthalic acid, isohexyl 2-isopropylphenyl ester.

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