Chemical Properties of Dimethylmalonic acid, pentyl 3-phenylpropyl ester

Dimethylmalonic acid, pentyl 3-phenylpropyl ester

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InChI
InChI=1S/C19H28O4/c1-4-5-9-14-22-17(20)19(2,3)18(21)23-15-10-13-16-11-7-6-8-12-16/h6-8,11-12H,4-5,9-10,13-15H2,1-3H3
InChI Key
XLSRUFAIYJHDEG-UHFFFAOYSA-N
Formula
C19H28O4
SMILES
CCCCCOC(=O)C(C)(C)C(=O)OCCCc1ccccc1
Molecular Weight1
320.42
Sources

Physical Properties

Property Value Unit Source
Δf -243.49 kJ/mol Joback Calculated Property
Δfgas -697.31 kJ/mol Joback Calculated Property
Δfus 37.17 kJ/mol Joback Calculated Property
Δvap 77.18 kJ/mol Joback Calculated Property
logPoct/wat 3.92 Crippen Calculated Property
Pc 1479.29 kPa Joback Calculated Property
Tboil 810.15 K Joback Calculated Property
Tc 1014.93 K Joback Calculated Property
Tfus 477.05 K Joback Calculated Property
Vc 1.03 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 821.04 J/mol×K 810.15 Joback Calculated Property
η 0.00 Pa×s 810.15 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 3
=CH- (ring) 5
=C< (ring) 1
-CH2- 7
>C< 1
>C=O (nonring) 2

Similar Compounds

Dimethylmalonic acid, hexyl 3-phenylpropyl ester. Dimethylmalonic acid, butyl 3-phenylpropyl ester. Dimethylmalonic acid, isohexyl 3-phenylpropyl ester. Dimethylmalonic acid, heptyl 3-phenylpropyl ester. Dimethylmalonic acid, decyl 3-phenylpropyl ester. Dimethylmalonic acid, 3-phenylpropyl tetradecyl ester. Dimethylmalonic acid, octadecyl 3-phenylpropyl ester. Dimethylmalonic acid, dodecyl 3-phenylpropyl ester. Dimethylmalonic acid, nonyl 3-phenylpropyl ester. Dimethylmalonic acid, 3-phenylpropyl tridecyl ester. Dimethylmalonic acid, octyl 3-phenylpropyl ester. Dimethylmalonic acid, heptadecyl 3-phenylpropyl ester. Dimethylmalonic acid, 3-phenylpropyl undecyl ester. Dimethylmalonic acid, hexadecyl 3-phenylpropyl ester. Dimethylmalonic acid, 3-phenylpropyl propyl ester.

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

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