Chemical Properties of Propanoic acid, 2-methyl-, (4-methoxyphenyl)methyl ester (CAS 71172-26-4)

Propanoic acid, 2-methyl-, (4-methoxyphenyl)methyl ester

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InChI
InChI=1S/C12H16O3/c1-9(2)12(13)15-8-10-4-6-11(14-3)7-5-10/h4-7,9H,8H2,1-3H3
InChI Key
ZOXXODFRADWDHG-UHFFFAOYSA-N
Formula
C12H16O3
SMILES
COc1ccc(COC(=O)C(C)C)cc1
Molecular Weight1
208.25
CAS
71172-26-4
Other Names
  • (4-methoxyphenyl)methyl isobutyrate
  • Anisyl isobutyrate
Sources

Physical Properties

Property Value Unit Source
Δf -188.42 kJ/mol Joback Calculated Property
Δfgas -448.25 kJ/mol Joback Calculated Property
Δfus 20.94 kJ/mol Joback Calculated Property
Δvap 56.42 kJ/mol Joback Calculated Property
logPoct/wat 2.39 Crippen Calculated Property
Pc 2458.04 kPa Joback Calculated Property
Tboil 603.89 K Joback Calculated Property
Tc 812.91 K Joback Calculated Property
Tfus 343.33 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 419.73 J/mol×K 603.89 Joback Calculated Property
η 0.00 Pa×s 603.89 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
-CH3 3

Similar Compounds

Anisyl propionate. Anisyl butyrate. Anisyl valerate. Benzenemethanol, 4-methoxy-, acetate. Anisyl acetate. Anisyl heptanoate. Glutaric acid, di(4-methoxybenzyl) ester. Succinic acid, di(4-methoxybenzyl) ester. Pimelic acid, ethyl 4-methoxybenzyl ester. Sebacic acid, ethyl 4-methoxybenzyl ester. Pimelic acid, 4-methoxybenzyl propyl ester. Glutaric acid, isobutyl 4-methoxybenzyl ester. Sebacic acid, 4-methoxybenzyl propyl ester. Pimelic acid, isobutyl 4-methoxybenzyl ester. Pimelic acid, butyl 4-methoxybenzyl ester.

Find more compounds similar to Propanoic acid, 2-methyl-, (4-methoxyphenyl)methyl ester.

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