Chemical Properties of 3-Phenylpropionic acid, 2-methylpentyl ester

3-Phenylpropionic acid, 2-methylpentyl ester

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InChI
InChI=1S/C15H22O2/c1-3-7-13(2)12-17-15(16)11-10-14-8-5-4-6-9-14/h4-6,8-9,13H,3,7,10-12H2,1-2H3
InChI Key
DMLLNUIUGYQCJQ-UHFFFAOYSA-N
Formula
C15H22O2
SMILES
CCCC(C)COC(=O)CCc1ccccc1
Molecular Weight1
234.33
Sources

Physical Properties

Property Value Unit Source
Δf -48.53 kJ/mol Joback Calculated Property
Δfgas -366.48 kJ/mol Joback Calculated Property
Δfus 27.91 kJ/mol Joback Calculated Property
Δvap 60.03 kJ/mol Joback Calculated Property
logPoct/wat 3.60 Crippen Calculated Property
Pc 1935.54 kPa Joback Calculated Property
Tboil 645.13 K Joback Calculated Property
Tc 846.21 K Joback Calculated Property
Tfus 342.39 K Joback Calculated Property
Vc 0.79 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 546.83 J/mol×K 645.13 Joback Calculated Property
η 0.00 Pa×s 645.13 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

3-Phenylpropionic acid, 2-methylbutyl ester. 3-Phenylpropionic acid, 4-methoxy-2-methylbutyl ester. Benzenepropanoic acid, hexyl ester. Benzenepropanoic acid, pentyl ester. 3-Phenylpropionic acid, 3-methylbutyl ester. 3-Phenylpropionic acid, 8-chlorooctyl ester. 3-Phenylpropionic acid, 3-methylbut-2-yl ester. Benzenepropanoic acid, 3-phenylpropyl ester. Benzenepropanoic acid, ethyl ester. 3-Phenylpropanoic anhydride. Succinic acid, 2-ethylhexyl 3-phenylpropyl ester. Glutaric acid, 2-ethylhexyl 3-phenylpropyl ester. Succinic acid, cyclohexylmethyl 3-phenylpropyl ester. Glutaric acid, cyclohexylmethyl 3-phenylpropyl ester. Pimelic acid, isobutyl 3-phenylpropyl ester.

Find more compounds similar to 3-Phenylpropionic acid, 2-methylpentyl ester.

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