Chemical Properties of Succinic acid, hexyl 3-methylbenzyl ester

Succinic acid, hexyl 3-methylbenzyl ester

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InChI
InChI=1S/C18H26O4/c1-3-4-5-6-12-21-17(19)10-11-18(20)22-14-16-9-7-8-15(2)13-16/h7-9,13H,3-6,10-12,14H2,1-2H3
InChI Key
UBUNXDJRLNDUEM-UHFFFAOYSA-N
Formula
C18H26O4
SMILES
CCCCCCOC(=O)CCC(=O)OCc1cccc(C)c1
Molecular Weight1
306.40
Sources

Physical Properties

Property Value Unit Source
Δf -264.38 kJ/mol Joback Calculated Property
Δfgas -679.39 kJ/mol Joback Calculated Property
Δfus 41.60 kJ/mol Joback Calculated Property
Δvap 76.91 kJ/mol Joback Calculated Property
logPoct/wat 3.94 Crippen Calculated Property
Pc 1552.45 kPa Joback Calculated Property
Tboil 795.48 K Joback Calculated Property
Tc 995.15 K Joback Calculated Property
Tfus 475.88 K Joback Calculated Property
Vc 0.98 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 761.25 J/mol×K 795.48 Joback Calculated Property
η 0.00 Pa×s 795.48 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Succinic acid, heptyl 3-methylbenzyl ester. Succinic acid, 3-methylbenzyl octyl ester. Succinic acid, 3-methylbenzyl tridecyl ester. Succinic acid, decyl 3-methylbenzyl ester. Succinic acid, dodecyl 3-methylbenzyl ester. Succinic acid, 3-methylbenzyl tetradecyl ester. Succinic acid, 3-methylbenzyl undecyl ester. Succinic acid, 3-methylbenzyl pentyl ester. Succinic acid, butyl 3-methylbenzyl ester. Succinic acid, 3-methylbenzyl propyl ester. Succinic acid, ethyl 3-methylbenzyl ester. Succinic acid, isobutyl 3-methylbenzyl ester. Butanedioic acid, hexyl phenylmethyl ester. Butanedioic acid, octyl phenylmethyl ester. Butanedioic acid, decyl phenylmethyl ester.

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