Chemical Properties of Dimethylmalonic acid, 3-phenylpropyl undecyl ester

Dimethylmalonic acid, 3-phenylpropyl undecyl ester

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InChI
InChI=1S/C25H40O4/c1-4-5-6-7-8-9-10-11-15-20-28-23(26)25(2,3)24(27)29-21-16-19-22-17-13-12-14-18-22/h12-14,17-18H,4-11,15-16,19-21H2,1-3H3
InChI Key
LIWDTDKVKYHISX-UHFFFAOYSA-N
Formula
C25H40O4
SMILES
CCCCCCCCCCCOC(=O)C(C)(C)C(=O)OCCCc1ccccc1
Molecular Weight1
404.58
Sources

Physical Properties

Property Value Unit Source
Δf -192.97 kJ/mol Joback Calculated Property
Δfgas -821.15 kJ/mol Joback Calculated Property
Δfus 52.71 kJ/mol Joback Calculated Property
Δvap 90.54 kJ/mol Joback Calculated Property
logPoct/wat 6.26 Crippen Calculated Property
Pc 991.38 kPa Joback Calculated Property
Tboil 947.43 K Joback Calculated Property
Tc 1160.67 K Joback Calculated Property
Tfus 544.67 K Joback Calculated Property
Vc 1.36 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1181.88 J/mol×K 947.43 Joback Calculated Property
η 0.00 Pa×s 947.43 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 5
=C< (ring) 1
-CH2- 13
>C< 1
-CH3 3

Similar Compounds

Dimethylmalonic acid, heptadecyl 3-phenylpropyl ester. Dimethylmalonic acid, octyl 3-phenylpropyl ester. Dimethylmalonic acid, octadecyl 3-phenylpropyl ester. Dimethylmalonic acid, nonyl 3-phenylpropyl ester. Dimethylmalonic acid, decyl 3-phenylpropyl ester. Dimethylmalonic acid, dodecyl 3-phenylpropyl ester. Dimethylmalonic acid, 3-phenylpropyl tetradecyl ester. Dimethylmalonic acid, 3-phenylpropyl tridecyl ester. Dimethylmalonic acid, hexadecyl 3-phenylpropyl ester. Dimethylmalonic acid, heptyl 3-phenylpropyl ester. Dimethylmalonic acid, hexyl 3-phenylpropyl ester. Dimethylmalonic acid, pentyl 3-phenylpropyl ester. Dimethylmalonic acid, isohexyl 3-phenylpropyl ester. Dimethylmalonic acid, butyl 3-phenylpropyl ester. Dimethylmalonic acid, di(3-phenylpropyl) ester.

Find more compounds similar to Dimethylmalonic acid, 3-phenylpropyl undecyl ester.

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