Chemical Properties of o-Methoxybenzoic acid, tridecyl ester

o-Methoxybenzoic acid, tridecyl ester

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InChI
InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-15-18-24-21(22)19-16-13-14-17-20(19)23-2/h13-14,16-17H,3-12,15,18H2,1-2H3
InChI Key
CAVXHIWURJXYIK-UHFFFAOYSA-N
Formula
C21H34O3
SMILES
CCCCCCCCCCCCCOC(=O)c1ccccc1OC
Molecular Weight1
334.49
Sources

Physical Properties

Property Value Unit Source
Δf -110.20 kJ/mol Joback Calculated Property
Δfgas -628.73 kJ/mol Joback Calculated Property
Δfus 47.77 kJ/mol Joback Calculated Property
Δvap 76.84 kJ/mol Joback Calculated Property
logPoct/wat 6.16 Crippen Calculated Property
Pc 1198.13 kPa Joback Calculated Property
Tboil 810.25 K Joback Calculated Property
Tc 1002.94 K Joback Calculated Property
Tfus 459.76 K Joback Calculated Property
Vc 1.15 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 916.24 J/mol×K 810.25 Joback Calculated Property
η 0.00 Pa×s 810.25 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 12
>C=O (nonring) 1

Similar Compounds

O-methoxybenzoic acid, pentadecyl ester. O-methoxybenzoic acid, decyl ester. O-methoxybenzoic acid, hexadecyl ester. o-Methoxybenzoic acid, tetradecyl ester. O-anisic acid, heptadecyl ester. o-Anisic acid, nonyl ester. O-methoxybenzoic acid, octadecyl ester. o-Anisic acid, undecyl ester. o-Methoxybenzoic acid, octyl ester. O-methoxybenzoic acid, heptyl ester. Benzoic acid, 2-methoxy-, hexyl ester. o-Methoxybenzoic acid, pentyl ester. Benzoic acid, 2-methoxy-, butyl ester. o-Anisic acid, dodec-9-ynyl ester. Benzoic acid, 2-methoxy-, 3-methylbutyl ester.

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