Chemical Properties of Isophthalic acid, hept-2-yl tetradecyl ester

Isophthalic acid, hept-2-yl tetradecyl ester

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InChI
InChI=1S/C29H48O4/c1-4-6-8-9-10-11-12-13-14-15-16-18-23-32-28(30)26-21-19-22-27(24-26)29(31)33-25(3)20-17-7-5-2/h19,21-22,24-25H,4-18,20,23H2,1-3H3
InChI Key
IOYDBOGVUJAXLK-UHFFFAOYSA-N
Formula
C29H48O4
SMILES
CCCCCCCCCCCCCCOC(=O)c1cccc(C(=O)OC(C)CCCCC)c1
Molecular Weight1
460.69
Sources

Physical Properties

Property Value Unit Source
Δf -174.20 kJ/mol Joback Calculated Property
Δfgas -911.71 kJ/mol Joback Calculated Property
Δfus 66.57 kJ/mol Joback Calculated Property
Δvap 101.01 kJ/mol Joback Calculated Property
logPoct/wat 8.670 Crippen Calculated Property
Pc 777.64 kPa Joback Calculated Property
Tboil 1046.72 K Joback Calculated Property
Tc 1288.88 K Joback Calculated Property
Tfus 584.85 K Joback Calculated Property
Vc 1.593 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1433.30 J/mol×K 1046.72 Joback Calculated Property
η 0.0000130 Pa×s 1046.72 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>CH- 1
-CH3 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 17
>C=O (nonring) 2

Similar Compounds

Isophthalic acid, hept-2-yl octyl ester. Isophthalic acid, hept-2-yl nonyl ester. Isophthalic acid, hept-2-yl pentadecyl ester. Isophthalic acid, decyl dec-2-yl ester. Isophthalic acid, dec-2-yl heptyl ester. Isophthalic acid, dec-2-yl octyl ester. Isophthalic acid, decyl hept-2-yl ester. Isophthalic acid, di(dec-2-yl) ester. Isophthalic acid, hexadecyl hex-3-yl ester. Isophthalic acid, dec-2-yl undecyl ester. Isophthalic acid, hept-2-yl undecyl ester. Isophthalic acid, dodecyl hept-2-yl ester. Isophthalic acid, dec-2-yl dodecyl ester. Isophthalic acid, hept-2-yl tridecyl ester. Isophthalic acid, dec-2-yl hexyl ester.

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