Chemical Properties of m-Toluic acid, 3-methylphenyl ester

m-Toluic acid, 3-methylphenyl ester

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InChI
InChI=1S/C15H14O2/c1-11-5-3-7-13(9-11)15(16)17-14-8-4-6-12(2)10-14/h3-10H,1-2H3
InChI Key
YAYGVOBOOBKUHX-UHFFFAOYSA-N
Formula
C15H14O2
SMILES
Cc1cccc(OC(=O)c2cccc(C)c2)c1
Molecular Weight1
226.27
Other Names
  • m-Toluylic acid, 3-methylphenyl ester
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
-CH3 2
>C=O (nonring) 1
=CH- (ring) 8

Similar Compounds

M-toluic acid, 3,5-dimethylphenyl ester. Isophthalic acid, di(3-methylphenyl) ester. Benzoic acid, 3-methyl-, 3-ethylphenyl ester. Isophthalic acid, di(3,4-dimethylphenyl) ester. Benzoic acid, 3-methylphenyl ester. P-toluic acid, 3,5-dimethylphenyl ester. M-toluic acid, 4-methoxyphenyl ester. m-Toluic acid, 4-benzyloxyphenyl ester. Diphenyl isophthalate. P-anisic acid, 3,5-dimethylphenyl ester. Trimesic acid, triphenyl ester. p-Toluylic acid, 3-methylphenyl ester. Isophthalic acid, ethyl 3-methylphenyl ester. m-Toluic acid, 4-cyanophenyl ester. p-Anisic acid, 3-methylphenyl ester.

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