Chemical Properties of M-toluic acid, 3,5-dimethylphenyl ester

M-toluic acid, 3,5-dimethylphenyl ester

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InChI
InChI=1S/C16H16O2/c1-11-5-4-6-14(8-11)16(17)18-15-9-12(2)7-13(3)10-15/h4-10H,1-3H3
InChI Key
KOXGVGQBHWUCCS-UHFFFAOYSA-N
Formula
C16H16O2
SMILES
Cc1cccc(C(=O)Oc2cc(C)cc(C)c2)c1
Molecular Weight1
240.30
Other Names
  • m-Toluylic acid, 3,5-dimethylphenyl ester
Sources

Physical Properties

Property Value Unit Source
Δf 45.85 kJ/mol Joback Calculated Property
Δfgas -179.72 kJ/mol Joback Calculated Property
Δfus 26.90 kJ/mol Joback Calculated Property
Δvap 66.90 kJ/mol Joback Calculated Property
logPoct/wat 3.83 Crippen Calculated Property
Pc 2287.14 kPa Joback Calculated Property
Tboil 710.07 K Joback Calculated Property
Tc 945.48 K Joback Calculated Property
Tfus 432.64 K Joback Calculated Property
Vc 0.74 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 516.08 J/mol×K 710.07 Joback Calculated Property
η 0.00 Pa×s 710.07 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< (ring) 5
>C=O (nonring) 1
-CH3 3
=CH- (ring) 7

Similar Compounds

m-Toluic acid, 3-methylphenyl ester. Isophthalic acid, di(3-methylphenyl) ester. Benzoic acid, 3-methyl-, 3-ethylphenyl ester. Isophthalic acid, di(3,4-dimethylphenyl) ester. P-toluic acid, 3,5-dimethylphenyl ester. Benzoic acid, 3-methylphenyl ester. P-anisic acid, 3,5-dimethylphenyl ester. m-Toluic acid, 4-benzyloxyphenyl ester. M-toluic acid, 4-methoxyphenyl ester. Diphenyl isophthalate. Trimesic acid, triphenyl ester. 4-Chlorobenzoic acid, 3,5-dimethylphenyl ester. 3-Trifluoromethylbenzoic acid, 3,5-dimethylphenyl ester. p-Toluylic acid, 3-methylphenyl ester. Isophthalic acid, di(2,5-dimethylphenyl) ester.

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