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

Isophthalic acid, hept-2-yl heptyl ester

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InChI
InChI=1S/C22H34O4/c1-4-6-8-9-11-16-25-21(23)19-14-12-15-20(17-19)22(24)26-18(3)13-10-7-5-2/h12,14-15,17-18H,4-11,13,16H2,1-3H3
InChI Key
HYKNYKMXORWRKB-UHFFFAOYSA-N
Formula
C22H34O4
SMILES
CCCCCCCOC(=O)c1cccc(C(=O)OC(C)CCCCC)c1
Molecular Weight1
362.50
Sources

Physical Properties

Property Value Unit Source
Δf -233.14 kJ/mol Joback Calculated Property
Δfgas -767.23 kJ/mol Joback Calculated Property
Δfus 48.44 kJ/mol Joback Calculated Property
Δvap 85.43 kJ/mol Joback Calculated Property
logPoct/wat 5.939 Crippen Calculated Property
Pc 1177.66 kPa Joback Calculated Property
Tboil 886.56 K Joback Calculated Property
Tc 1090.83 K Joback Calculated Property
Tfus 505.96 K Joback Calculated Property
Vc 1.202 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 997.77 J/mol×K 886.56 Joback Calculated Property
η 0.0000377 Pa×s 886.56 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- 10
-CH3 3

Similar Compounds

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

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

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