Chemical Properties of 1,3,5-Benzenetricarboxylic acid, triethyl ester (CAS 4105-92-4)

1,3,5-Benzenetricarboxylic acid, triethyl ester

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InChI
InChI=1S/C15H18O6/c1-4-19-13(16)10-7-11(14(17)20-5-2)9-12(8-10)15(18)21-6-3/h7-9H,4-6H2,1-3H3
InChI Key
KXGOWZRHSOJOLF-UHFFFAOYSA-N
Formula
C15H18O6
SMILES
CCOC(=O)c1cc(C(=O)OCC)cc(C(=O)OCC)c1
Molecular Weight1
294.30
CAS
4105-92-4
Other Names
  • Triethyl 1,3,5-benzenetricarboxylate
  • Triethyl trimesate
  • Trimesic acid triethyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -533.19 kJ/mol Joback Calculated Property
Δfgas -873.74 kJ/mol Joback Calculated Property
Δfus 36.23 kJ/mol Joback Calculated Property
Δvap 80.05 kJ/mol Joback Calculated Property
logPoct/wat 2.22 Crippen Calculated Property
Pc 2030.89 kPa Joback Calculated Property
Tboil 808.11 K Joback Calculated Property
Tc 1018.00 K Joback Calculated Property
Tfus 526.75 K Joback Calculated Property
Vc 0.84 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 634.51 J/mol×K 808.11 Joback Calculated Property
η 0.00 Pa×s 808.11 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

1,3-Benzenedicarboxylic acid, diethyl ester. Diallyl isophthalate. Isophthalic acid, 2-chloroethyl ethyl ester. Dipropyl isophthalate. Ethyl m-methylbenzoate. Isophthalic acid, di(2-methoxyethyl) ester. Isophthalic acid, ethyl 2-methoxyethyl ester. 1,3,5-Benzenetricarboxylic acid, trimethyl ester. 1,3-Benzenedicarboxylic acid, dimethyl ester. 1,3-Benzenedicarboxylic acid, monomethyl ester. Isophthalic acid, di(2-ethoxyethyl) ester. Dibutyl isophthalate. Isophthalic acid, 2-ethoxyethyl ethyl ester. Isophthalic acid, di(3-methylbut-2-en-1-yl) ester. Isophthalic acid, ethyl 3-methylbut-2-en-1-yl ester.

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