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

Isophthalic acid, hept-2-yl undecyl ester

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

Physical Properties

Property Value Unit Source
Δf -199.46 kJ/mol Joback Calculated Property
Δfgas -849.79 kJ/mol Joback Calculated Property
Δfus 58.80 kJ/mol Joback Calculated Property
Δvap 94.33 kJ/mol Joback Calculated Property
logPoct/wat 7.500 Crippen Calculated Property
Pc 919.39 kPa Joback Calculated Property
Tboil 978.08 K Joback Calculated Property
Tc 1197.65 K Joback Calculated Property
Tfus 551.04 K Joback Calculated Property
Vc 1.425 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1244.04 J/mol×K 978.08 Joback Calculated Property
η 0.0000207 Pa×s 978.08 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 14
>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, hept-2-yl tetradecyl 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, 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.

Find more compounds similar to Isophthalic acid, hept-2-yl undecyl ester.

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