Chemical Properties of P-methoxybenzoic acid, octadecyl ester (CAS 56954-78-0)

P-methoxybenzoic acid, octadecyl ester

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InChI
InChI=1S/C26H44O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-29-26(27)24-19-21-25(28-2)22-20-24/h19-22H,3-18,23H2,1-2H3
InChI Key
ITAWVWUURIEPJF-UHFFFAOYSA-N
Formula
C26H44O3
SMILES
CCCCCCCCCCCCCCCCCCOC(=O)c1ccc(OC)cc1
Molecular Weight1
404.63
CAS
56954-78-0
Sources

Physical Properties

Property Value Unit Source
Δf -68.10 kJ/mol Joback Calculated Property
Δfgas -731.93 kJ/mol Joback Calculated Property
Δfus 60.72 kJ/mol Joback Calculated Property
Δvap 87.97 kJ/mol Joback Calculated Property
logPoct/wat 8.114 Crippen Calculated Property
Pc 881.04 kPa Joback Calculated Property
Tboil 924.65 K Joback Calculated Property
Tc 1132.03 K Joback Calculated Property
Tfus 516.11 K Joback Calculated Property
Vc 1.425 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1224.64 J/mol×K 924.65 Joback Calculated Property
η 0.0000241 Pa×s 924.65 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 17
-CH3 2

Similar Compounds

p-Methoxybenzoic acid, tetradecyl ester. Benzoic acid, 4-methoxy-, undecyl ester. P-anisic acid, heptadecyl ester. P-methoxybenzoic acid, tridecyl ester. Benzoic acid, 4-methoxy-, pentadecyl ester. p-Methoxybenzoic acid, octyl ester. p-Methoxybenzoic acid, hexadecyl ester. Benzoic acid, 4-methoxy-, nonyl ester. Benzoic acid, 4-methoxy-, decyl ester. Benzoic acid, 4-methoxy-, heptyl ester. p-Methoxybenzoic acid, hexyl ester. Amyl anisate. 4-Methoxybenzoic acid, 8-chlorooctyl ester. Benzoic acid, 4-methoxy-, butyl ester. Heptyl p-butoxybenzoate.

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