Chemical Properties of Methyl 3-hydroxydodecanoate (CAS 72864-23-4)

Methyl 3-hydroxydodecanoate

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InChI
InChI=1S/C13H26O3/c1-3-4-5-6-7-8-9-10-12(14)11-13(15)16-2/h12,14H,3-11H2,1-2H3
InChI Key
OZXCINYANGIBDB-UHFFFAOYSA-N
Formula
C13H26O3
SMILES
CCCCCCCCCC(O)CC(=O)OC
Molecular Weight1
230.34
CAS
72864-23-4
Other Names
  • 3-Hydroxydodecanoic acid, methyl ester
  • Dodecanoic acid, 3-hydroxy, methyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -314.60 kJ/mol Joback Calculated Property
Δfgas -713.96 kJ/mol Joback Calculated Property
Δfus 32.78 kJ/mol Joback Calculated Property
Δvap 69.98 kJ/mol Joback Calculated Property
logPoct/wat 3.05 Crippen Calculated Property
Pc 1857.91 kPa Joback Calculated Property
Tboil 664.87 K Joback Calculated Property
Tc 833.68 K Joback Calculated Property
Tfus 354.25 K Joback Calculated Property
Vc 0.80 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 583.63 J/mol×K 664.87 Joback Calculated Property
η 0.00 Pa×s 664.87 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 2
-OH (alcohol) 1
-CH2- 9
>C=O (nonring) 1

Similar Compounds

Octanoic acid, 3-hydroxy-, methyl ester. Hexadecanoic acid, 3-hydroxy-, methyl ester. Methyl 3-hydroxytetradecanoate. Decanoic acid, 3-hydroxy-, methyl ester. Heptanoic acid, 3-hydroxy-, methyl ester. iso-17:0, 3-OH, methyl ester. Hexanoic acid, 3-hydroxy-, methyl ester. Dodecanoic acid, 3-hydroxy-, ethyl ester. Ethyl 3-hydroxyoctadecanoate. Ethyl 3-hydroxytetracosanoate. ethyl 3-hydroxydecanoate. Ethyl 3-hydroxyicosanoate. Tridecanoic acid, 3-hydroxy-, ethyl ester. ethyl 3-hydroxyoctanoate. Ethyl 3-hydroxydocosanoate.

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