Chemical Properties of Dimethylmalonic acid, pentadecyl 2-phenethyl ester

Dimethylmalonic acid, pentadecyl 2-phenethyl ester

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InChI
InChI=1S/C28H46O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-23-31-26(29)28(2,3)27(30)32-24-22-25-20-17-16-18-21-25/h16-18,20-21H,4-15,19,22-24H2,1-3H3
InChI Key
XYEZXYLEUNCHJA-UHFFFAOYSA-N
Formula
C28H46O4
SMILES
CCCCCCCCCCCCCCCOC(=O)C(C)(C)C(=O)OCCc1ccccc1
Molecular Weight1
446.66
Sources

Physical Properties

Property Value Unit Source
Δf -167.71 kJ/mol Joback Calculated Property
Δfgas -883.07 kJ/mol Joback Calculated Property
Δfus 60.48 kJ/mol Joback Calculated Property
Δvap 97.21 kJ/mol Joback Calculated Property
logPoct/wat 7.43 Crippen Calculated Property
Pc 833.38 kPa Joback Calculated Property
Tboil 1016.07 K Joback Calculated Property
Tc 1245.70 K Joback Calculated Property
Tfus 578.48 K Joback Calculated Property
Vc 1.53 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1370.03 J/mol×K 1016.07 Joback Calculated Property
η 0.00 Pa×s 1016.07 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 5
=C< (ring) 1
-CH2- 16
>C< 1
-CH3 3

Similar Compounds

Dimethylmalonic acid, heptadecyl 2-phenethyl ester. Dimethylmalonic acid, 2-phenethyl undecyl ester. Dimethylmalonic acid, nonyl 2-phenethyl ester. Dimethylmalonic acid, octadecyl 2-phenethyl ester. Dimethylmalonic acid, 2-phenethyl tridecyl ester. Dimethylmalonic acid, hexadecyl 2-phenethyl ester. Dimethylmalonic acid, octyl 2-phenethyl ester. Dimethylmalonic acid, dodecyl 2-phenethyl ester. Dimethylmalonic acid, heptyl 2-phenethyl ester. Dimethylmalonic acid, pentyl 2-phenethyl ester. Dimethylmalonic acid, isohexyl 2-phenethyl ester. Dimethylmalonic acid, butyl 2-phenethyl ester. Dimethylmalonic acid, 2-phenethyl propyl ester. Dimethylmalonic acid, isobutyl 2-phenethyl ester. Dimethylmalonic acid, ethyl 2-phenethyl ester.

Find more compounds similar to Dimethylmalonic acid, pentadecyl 2-phenethyl ester.

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