Chemical Properties of Trimesic acid, triphenyl ester (CAS 7383-70-2)

Trimesic acid, triphenyl ester

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InChI
InChI=1S/C27H18O6/c28-25(31-22-10-4-1-5-11-22)19-16-20(26(29)32-23-12-6-2-7-13-23)18-21(17-19)27(30)33-24-14-8-3-9-15-24/h1-18H
InChI Key
ZNOKZTBEFWQAHD-UHFFFAOYSA-N
Formula
C27H18O6
SMILES
O=C(Oc1ccccc1)c1cc(C(=O)Oc2ccccc2)cc(C(=O)Oc2ccccc2)c1
Molecular Weight1
438.43
CAS
7383-70-2
Other Names
  • Trimesic acid, triphenyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -94.92 kJ/mol Joback Calculated Property
Δfgas -411.83 kJ/mol Joback Calculated Property
Δfus 49.43 kJ/mol Joback Calculated Property
Δvap 113.59 kJ/mol Joback Calculated Property
logPoct/wat 5.34 Crippen Calculated Property
Pc 1768.38 kPa Joback Calculated Property
Tboil 1162.71 K Joback Calculated Property
Tc 1436.10 K Joback Calculated Property
Tfus 741.25 K Joback Calculated Property
Vc 1.19 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 986.76 J/mol×K 1162.71 Joback Calculated Property
η 0.00 Pa×s 1162.71 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
=C< (ring) 6
>C=O (nonring) 3
=CH- (ring) 18

Similar Compounds

Diphenyl isophthalate. m-Toluic acid, 4-benzyloxyphenyl ester. M-toluic acid, 4-methoxyphenyl ester. Isophthalic acid, di(3-methylphenyl) ester. Isophthalic acid, ethyl phenyl ester. Isophthalic acid, di(2-methylphenyl) ester. m-Toluic acid, 3-methylphenyl ester. M-toluic acid, 3,5-dimethylphenyl ester. m-Toluic acid, 4-cyanophenyl ester. Isophthalic acid, di(3,4-dimethylphenyl) ester. Isophthalic acid, di(3,5-dichlorophenyl) ester. Isophthalic acid, monochloride, phenyl ester. m-Toluic acid, 2-naphthyl ester. Isophthalic acid, phenyl propyl ester. Isophthalic acid, ethyl 4-methoxyphenyl ester.

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