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

Isophthalic acid, hept-2-yl nonyl ester

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InChI
InChI=1S/C24H38O4/c1-4-6-8-9-10-11-13-18-27-23(25)21-16-14-17-22(19-21)24(26)28-20(3)15-12-7-5-2/h14,16-17,19-20H,4-13,15,18H2,1-3H3
InChI Key
OMPSEQOVBSYDGY-UHFFFAOYSA-N
Formula
C24H38O4
SMILES
CCCCCCCCCOC(=O)c1cccc(C(=O)OC(C)CCCCC)c1
Molecular Weight1
390.56
Sources

Physical Properties

Property Value Unit Source
Δf -216.30 kJ/mol Joback Calculated Property
Δfgas -808.51 kJ/mol Joback Calculated Property
Δfus 53.62 kJ/mol Joback Calculated Property
Δvap 89.88 kJ/mol Joback Calculated Property
logPoct/wat 6.720 Crippen Calculated Property
Pc 1036.57 kPa Joback Calculated Property
Tboil 932.32 K Joback Calculated Property
Tc 1142.37 K Joback Calculated Property
Tfus 528.50 K Joback Calculated Property
Vc 1.313 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1119.86 J/mol×K 932.32 Joback Calculated Property
η 0.0000281 Pa×s 932.32 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- 12
-CH3 3

Similar Compounds

Isophthalic acid, hept-2-yl octyl 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, 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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