Chemical Properties of p-Toluylic acid, 3-methylphenyl ester

p-Toluylic acid, 3-methylphenyl ester

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InChI
InChI=1S/C15H14O2/c1-11-6-8-13(9-7-11)15(16)17-14-5-3-4-12(2)10-14/h3-10H,1-2H3
InChI Key
YOLXLRZYVQUCIC-UHFFFAOYSA-N
Formula
C15H14O2
SMILES
Cc1ccc(C(=O)Oc2cccc(C)c2)cc1
Molecular Weight1
226.27
Sources

Physical Properties

Property Value Unit Source
Δf 47.06 kJ/mol Joback Calculated Property
Δfgas -147.61 kJ/mol Joback Calculated Property
Δfus 24.70 kJ/mol Joback Calculated Property
Δvap 64.02 kJ/mol Joback Calculated Property
logPoct/wat 3.52 Crippen Calculated Property
Pc 2550.76 kPa Joback Calculated Property
Tboil 682.21 K Joback Calculated Property
Tc 921.60 K Joback Calculated Property
Tfus 408.85 K Joback Calculated Property
Vc 0.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 464.87 J/mol×K 682.21 Joback Calculated Property
η 0.00 Pa×s 682.21 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< (ring) 4
>C=O (nonring) 1
-CH3 2
=CH- (ring) 8

Similar Compounds

P-toluic acid, 3,5-dimethylphenyl ester. Benzoic acid, 3-methylphenyl ester. 4-Ethylbenzoic acid, 3-methylphenyl ester. 4-Methylbenzoic acid, 3-ethylphenyl ester. 4-Ethylbenzoic acid, 3,5-dimethylphenyl ester. Benzoic acid, 4-methyl-, phenyl ester. Benzoic acid, 3-ethylphenyl ester. p-Anisic acid, 3-methylphenyl ester. 4-Trifluoromethylbenzoic acid, 3-methylphenyl ester. Diphenyl terephthalate. 4-Butylbenzoic acid, 3-methylphenyl ester. m-Toluic acid, 3-methylphenyl ester. P-anisic acid, 3,5-dimethylphenyl ester. P-toluic acid, 4-methoxyphenyl ester. p-Toluic acid, 4-benzyloxyphenyl ester.

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