Chemical Properties of Octacosanoic acid, methyl ester (CAS 55682-92-3)

Octacosanoic acid, methyl ester

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InChI
InChI=1S/C29H58O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(30)31-2/h3-28H2,1-2H3
InChI Key
ZKHOYAKAFALNQD-UHFFFAOYSA-N
Formula
C29H58O2
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC
Molecular Weight1
438.77
CAS
55682-92-3
Other Names
  • Methyl octacosanoate
  • Montanic acid, methyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -40.62 kJ/mol Joback Calculated Property
Δfgas -886.69 kJ/mol Joback Calculated Property
Δfus 73.65 kJ/mol Joback Calculated Property
Δvap 157.50 ± 4.50 kJ/mol NIST
logPoct/wat 10.32 Crippen Calculated Property
Pc 638.98 kPa Joback Calculated Property
Tboil 939.21 K Joback Calculated Property
Tc 1161.87 K Joback Calculated Property
Tfus 488.75 K Joback Calculated Property
Vc 1.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1482.38 J/mol×K 939.21 Joback Calculated Property
η 0.00 Pa×s 939.21 Joback Calculated Property
ΔfusH 109.70 kJ/mol 340.2 NIST

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 26
>C=O (nonring) 1
-CH3 2

Similar Compounds

Tetradecanoic acid, methyl ester. Octanoic acid, methyl ester. Heneicosanoic acid, methyl ester. Nonanoic acid, 9-oxo-, methyl ester. methyl tritriacontanoate. Tetracosanoic acid, methyl ester. Sebacic acid monomethyl ester. Nonanedioic acid, monomethyl ester. Undecanoic acid, methyl ester. Pentadecanoic acid, methyl ester. 29:0, Methyl ester. 10-Hydroxydecanoic acid, methyl ester. Hexadecanoic acid, methyl ester. Tridecanoic acid, methyl ester. Dodecanoic acid, 12-hydroxy-, methyl ester.

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