Chemical Properties of Benzoic acid, 3-methoxy-, decyl ester (CAS 69833-38-1)

Benzoic acid, 3-methoxy-, decyl ester

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InChI
InChI=1S/C18H28O3/c1-3-4-5-6-7-8-9-10-14-21-18(19)16-12-11-13-17(15-16)20-2/h11-13,15H,3-10,14H2,1-2H3
InChI Key
KNUKZBZOCHMAEK-UHFFFAOYSA-N
Formula
C18H28O3
SMILES
CCCCCCCCCCOC(=O)c1cccc(OC)c1
Molecular Weight1
292.41
CAS
69833-38-1
Other Names
  • m-Methoxybenzoic acid, decyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -135.46 kJ/mol Joback Calculated Property
Δfgas -566.81 kJ/mol Joback Calculated Property
Δfus 40.00 kJ/mol Joback Calculated Property
Δvap 70.17 kJ/mol Joback Calculated Property
logPoct/wat 4.99 Crippen Calculated Property
Pc 1478.15 kPa Joback Calculated Property
Tboil 741.61 K Joback Calculated Property
Tc 934.08 K Joback Calculated Property
Tfus 425.95 K Joback Calculated Property
Vc 0.98 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 740.43 J/mol×K 741.61 Joback Calculated Property
η 0.00 Pa×s 741.61 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 9
-CH3 2

Similar Compounds

m-Methoxybenzoic acid, hexadecyl ester. Benzoic acid, 3-methoxy-, undecyl ester. Benzoic acid, 3-methoxy-, nonyl ester. m-Methoxybenzoic acid, tetradecyl ester. Benzoic acid, 3-methoxy-, tridecyl ester. M-methoxybenzoic acid, octyl ester. Benzoic acid, 3-methoxy-, pentadecyl ester. M-methoxybenzoic acid, octadecyl ester. M-anisic acid, heptadecyl ester. Benzoic acid, 3-methoxy-, heptyl ester. m-Methoxybenzoic acid, hexyl ester. M-methoxybenzoic acid, pentyl ester. M-anisic acid, dodec-9-ynyl ester. Benzoic acid, 3-methoxy-, butyl ester. Benzoic acid, 3-methoxy-, 3-methylbutyl ester.

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