Chemical Properties of m-Anisic acid, cyclobutyl ester

m-Anisic acid, cyclobutyl ester

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InChI
InChI=1S/C12H14O3/c1-14-11-7-2-4-9(8-11)12(13)15-10-5-3-6-10/h2,4,7-8,10H,3,5-6H2,1H3
InChI Key
FNCNTMFPAUQCCX-UHFFFAOYSA-N
Formula
C12H14O3
SMILES
COc1cccc(C(=O)OC2CCC2)c1
Molecular Weight1
206.24
Sources

Physical Properties

Property Value Unit Source
Δf -137.33 kJ/mol Joback Calculated Property
Δfgas -376.33 kJ/mol Joback Calculated Property
Δfus 20.50 kJ/mol Joback Calculated Property
Δvap 56.90 kJ/mol Joback Calculated Property
logPoct/wat 2.40 Crippen Calculated Property
Pc 2859.68 kPa Joback Calculated Property
Tboil 615.34 K Joback Calculated Property
Tc 841.96 K Joback Calculated Property
Tfus 372.75 K Joback Calculated Property
Vc 0.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 406.05 J/mol×K 615.34 Joback Calculated Property
η 0.00 Pa×s 615.34 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Benzoic acid, 3-methoxy-, 1-methylpropyl ester. Benzoic acid, 3-methoxy-, butyl ester. M-methoxybenzoic acid, pentyl ester. m-Methoxybenzoic acid, hexyl ester. Benzoic acid, 3-methoxy-, 3-methylbutyl ester. Benzoic acid, 3-methoxy-, propyl ester. Benzoic acid, 3-methoxy-, heptyl ester. Benzoic acid, 3-methoxy-, 2-methylbutyl ester. Benzoic acid, 3-methoxy-, isopropyl ester. Benzoic acid, 3-methoxy-, decyl ester. M-methoxybenzoic acid, octyl ester. m-Methoxybenzoic acid, tetradecyl ester. M-anisic acid, heptadecyl ester. Benzoic acid, 3-methoxy-, tridecyl ester. M-methoxybenzoic acid, octadecyl ester.

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