Chemical Properties of Dimethyl 3,6,9,12,15,18,21,24,27-nonaoxanonacosane-1,29-dioate

Dimethyl 3,6,9,12,15,18,21,24,27-nonaoxanonacosane-1,29-dioate

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InChI
InChI=1S/C22H42O13/c1-25-21(23)19-34-17-15-32-13-11-30-9-7-28-5-3-27-4-6-29-8-10-31-12-14-33-16-18-35-20-22(24)26-2/h3-20H2,1-2H3
InChI Key
NYAFCYGDUIRDMW-UHFFFAOYSA-N
Formula
C22H42O13
SMILES
COC(=O)COCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)OC
Molecular Weight1
514.56
Sources

Physical Properties

Property Value Unit Source
Δf -1278.48 kJ/mol Joback Calculated Property
Δfgas -2176.99 kJ/mol Joback Calculated Property
Δfus 69.00 kJ/mol Joback Calculated Property
Δvap 104.57 kJ/mol Joback Calculated Property
logPoct/wat -0.52 Crippen Calculated Property
Pc 869.65 kPa Joback Calculated Property
Tboil 1057.12 K Joback Calculated Property
Tc 1329.23 K Joback Calculated Property
Tfus 682.09 K Joback Calculated Property
Vc 1.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1355.45 J/mol×K 1057.12 Joback Calculated Property
η 0.00 Pa×s 1057.12 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 11
-CH2- 18
>C=O (nonring) 2
-CH3 2

Similar Compounds

Ethyl 20-hydroxy-3,6,9,12,15,18-hexaoxaicosan-1-oate. 2,5,8,11,14,17,20-Heptaoxadocosan-22-oic acid. Acetic acid, ethoxy-, ethyl ester. Acetic acid, methoxy-, ethyl ester. Diglycolic acid. Sodium diglycolate. P-dioxan-2-one. Ethanedioic acid, diethyl ester. Butyl 2,5,8,11,14,17,20,23,26,29,32-undecaoxatetratriacontan-34-oate. Acetic acid, methoxy-, methyl ester. Diglycolic acid, ethyl isobutyl ester. Diglycolic acid, di(isobutyl) ester. Diglycolic acid, isobutyl propyl ester. Acetic acid, ethoxy-. Acetic acid, methoxy-, anhydride.

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