Chemical Properties of Pimelic acid, butyl phenethyl ester

Pimelic acid, butyl phenethyl ester

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InChI
InChI=1S/C19H28O4/c1-2-3-15-22-18(20)12-8-5-9-13-19(21)23-16-14-17-10-6-4-7-11-17/h4,6-7,10-11H,2-3,5,8-9,12-16H2,1H3
InChI Key
YCXVOZALRXRDAB-UHFFFAOYSA-N
Formula
C19H28O4
SMILES
CCCCOC(=O)CCCCCC(=O)OCCc1ccccc1
Molecular Weight1
320.42
Sources

Physical Properties

Property Value Unit Source
Δf -246.33 kJ/mol Joback Calculated Property
Δfgas -688.56 kJ/mol Joback Calculated Property
Δfus 44.58 kJ/mol Joback Calculated Property
Δvap 78.48 kJ/mol Joback Calculated Property
logPoct/wat 4.07 Crippen Calculated Property
Pc 1457.90 kPa Joback Calculated Property
Tboil 813.38 K Joback Calculated Property
Tc 1012.05 K Joback Calculated Property
Tfus 474.63 K Joback Calculated Property
Vc 1.04 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 819.71 J/mol×K 813.38 Joback Calculated Property
η 0.00 Pa×s 813.38 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 5
=C< (ring) 1
-CH2- 10
-CH3 1

Similar Compounds

Pimelic acid, heptyl phenethyl ester. Pimelic acid, phenethyl tridecyl ester. Pimelic acid, decyl phenethyl ester. Pimelic acid, phenethyl undecyl ester. Pimelic acid, octyl phenethyl ester. Pimelic acid, dodecyl phenethyl ester. Pimelic acid, phenethyl propyl ester. Pimelic acid, di(phenethyl) ester. Heptanoic acid, 2-phenylethyl ester. Pimelic acid, ethyl phenethyl ester. Dodecanoic acid, 2-phenylethyl ester. Phenethyl icosanoate. Decanoic acid, 2-phenylethyl ester. Phenethyl stearate. 2-Phenylethyl docosanoate.

Find more compounds similar to Pimelic acid, butyl phenethyl ester.

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