Chemical Properties of P-anisic acid, 3,5-dimethylphenyl ester

P-anisic acid, 3,5-dimethylphenyl ester

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InChI
InChI=1S/C16H16O3/c1-11-8-12(2)10-15(9-11)19-16(17)13-4-6-14(18-3)7-5-13/h4-10H,1-3H3
InChI Key
LQPVMUVOUTZDSK-UHFFFAOYSA-N
Formula
C16H16O3
SMILES
COc1ccc(C(=O)Oc2cc(C)cc(C)c2)cc1
Molecular Weight1
256.30
Sources

Physical Properties

Property Value Unit Source
Δf -59.15 kJ/mol Joback Calculated Property
Δfgas -311.94 kJ/mol Joback Calculated Property
Δfus 28.09 kJ/mol Joback Calculated Property
Δvap 69.31 kJ/mol Joback Calculated Property
logPoct/wat 3.53 Crippen Calculated Property
Pc 2250.40 kPa Joback Calculated Property
Tboil 732.49 K Joback Calculated Property
Tc 964.63 K Joback Calculated Property
Tfus 454.87 K Joback Calculated Property
Vc 0.76 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 542.39 J/mol×K 732.49 Joback Calculated Property
η 0.00 Pa×s 732.49 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=C< (ring) 5
>C=O (nonring) 1
-CH3 3
=CH- (ring) 7

Similar Compounds

p-Anisic acid, 3-methylphenyl ester. P-toluic acid, 3,5-dimethylphenyl ester. Benzoic acid, 3-methylphenyl ester. M-toluic acid, 3,5-dimethylphenyl ester. m-Toluic acid, 3-methylphenyl ester. Benzoic acid, 4-methoxy-, phenyl ester. p-Toluylic acid, 3-methylphenyl ester. 4-Chlorobenzoic acid, 3,5-dimethylphenyl ester. 4-Fluorobenzoic acid, 3,5-dimethylphenyl ester. 4-Ethylbenzoic acid, 3,5-dimethylphenyl ester. m-Anisic acid, 3,5-dimethylphenyl ester. Isophthalic acid, di(3,4-dimethylphenyl) ester. p-Anisic acid, 4-methoxyphenyl ester. Isophthalic acid, di(3-methylphenyl) ester. Benzoic acid, 3-ethylphenyl ester.

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