Chemical Properties of Terephthalic acid, di(3-methoxyphenyl) ester

Terephthalic acid, di(3-methoxyphenyl) ester

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InChI
InChI=1S/C22H18O6/c1-25-17-5-3-7-19(13-17)27-21(23)15-9-11-16(12-10-15)22(24)28-20-8-4-6-18(14-20)26-2/h3-14H,1-2H3
InChI Key
KODPEPBVDZOCQM-UHFFFAOYSA-N
Formula
C22H18O6
SMILES
COc1cccc(OC(=O)c2ccc(C(=O)Oc3cccc(OC)c3)cc2)c1
Molecular Weight1
378.37
Sources

Physical Properties

Property Value Unit Source
Δf -235.14 kJ/mol Joback Calculated Property
Δfgas -576.27 kJ/mol Joback Calculated Property
Δfus 41.64 kJ/mol Joback Calculated Property
Δvap 96.51 kJ/mol Joback Calculated Property
logPoct/wat 4.142 Crippen Calculated Property
Pc 1851.52 kPa Joback Calculated Property
Tboil 995.16 K Joback Calculated Property
Tc 1242.86 K Joback Calculated Property
Tfus 643.30 K Joback Calculated Property
Vc 1.028 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 840.46 J/mol×K 995.16 Joback Calculated Property
η 0.0000255 Pa×s 995.16 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 4
=C< (ring) 6
>C=O (nonring) 2
-CH3 2
=CH- (ring) 12

Similar Compounds

Resorcinol dibenzoate. 1,3-Benzenediol, monobenzoate. Diphenyl terephthalate. Benzoic acid, 4-methyl-, phenyl ester. Terephthalic acid, 3-methoxyphenyl propyl ester. P-toluic acid, 4-methoxyphenyl ester. p-Toluic acid, 4-benzyloxyphenyl ester. Terephthalic acid, butyl 3-methoxyphenyl ester. Terephthalic acid, isobutyl 3-methoxyphenyl ester. Terephthalic acid, 3-methoxyphenyl pentyl ester. Benzoic acid, phenyl ester. Benzoic acid, 4-cyano-, phenyl ester. Terephthalic acid, hexyl 3-methoxyphenyl ester. Terephthalic acid, 3-methoxyphenyl octyl ester. Terephthalic acid, 3-methoxyphenyl nonyl ester.

Find more compounds similar to Terephthalic acid, di(3-methoxyphenyl) ester.

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