Chemical Properties of p-Toluic acid, 4-benzyloxyphenyl ester

p-Toluic acid, 4-benzyloxyphenyl ester

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InChI
InChI=1S/C21H18O3/c1-16-7-9-18(10-8-16)21(22)24-20-13-11-19(12-14-20)23-15-17-5-3-2-4-6-17/h2-14H,15H2,1H3
InChI Key
UEXNAAFGIOCCME-UHFFFAOYSA-N
Formula
C21H18O3
SMILES
Cc1ccc(C(=O)Oc2ccc(OCc3ccccc3)cc2)cc1
Molecular Weight1
318.37
Other Names
  • p-Toluylic acid, 4-benzyloxyphenyl ester
Sources

Physical Properties

Property Value Unit Source
Δf 104.99 kJ/mol Joback Calculated Property
Δfgas -167.14 kJ/mol Joback Calculated Property
Δfus 35.47 kJ/mol Joback Calculated Property
Δvap 82.06 kJ/mol Joback Calculated Property
logPoct/wat 4.79 Crippen Calculated Property
Pc 1989.43 kPa Joback Calculated Property
Tboil 868.59 K Joback Calculated Property
Tc 1118.04 K Joback Calculated Property
Tfus 525.12 K Joback Calculated Property
Vc 0.93 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 726.51 J/mol×K 868.59 Joback Calculated Property
η 0.00 Pa×s 868.59 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 1
=CH- (ring) 13
=C< (ring) 5
-CH2- 1
>C=O (nonring) 1

Similar Compounds

P-toluic acid, 4-methoxyphenyl ester. Benzoic acid, 4-methyl-, phenyl ester. Diphenyl terephthalate. 1,4-Benzenediol, monobenzoate. 4-Ethylbenzoic acid, 4-methoxyphenyl ester. 4-Ethylbenzoic acid, 4-benzyloxyphenyl ester. Benzoic acid, phenyl ester. Benzoic acid, 4-cyano-, phenyl ester. 4-Trifluoromethylbenzoic acid, 4-benzyloxyphenyl ester. 4-Trifluoromethylbenzoic acid, 4-methoxyphenyl ester. p-Toluylic acid, 3-methylphenyl ester. 4-Butylbenzoic acid, 4-methoxyphenyl ester. 4-Butylbenzoic acid, 4-benzyloxyphenyl ester. p-Anisic acid, 4-methoxyphenyl ester. P-toluic acid, 4-cyanophenyl ester.

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