Chemical Properties of 3-Phenylpropionic acid, 8-chlorooctyl ester

3-Phenylpropionic acid, 8-chlorooctyl ester

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InChI
InChI=1S/C17H25ClO2/c18-14-8-3-1-2-4-9-15-20-17(19)13-12-16-10-6-5-7-11-16/h5-7,10-11H,1-4,8-9,12-15H2
InChI Key
MZSRWNOOTLGPIZ-UHFFFAOYSA-N
Formula
C17H25ClO2
SMILES
O=C(CCc1ccccc1)OCCCCCCCCCl
Molecular Weight1
296.83
Sources

Physical Properties

Property Value Unit Source
Δf -41.18 kJ/mol Joback Calculated Property
Δfgas -418.22 kJ/mol Joback Calculated Property
Δfus 40.81 kJ/mol Joback Calculated Property
Δvap 69.25 kJ/mol Joback Calculated Property
logPoct/wat 4.74 Crippen Calculated Property
Pc 1587.28 kPa Joback Calculated Property
Tboil 728.76 K Joback Calculated Property
Tc 926.10 K Joback Calculated Property
Tfus 409.85 K Joback Calculated Property
Vc 0.95 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 685.56 J/mol×K 728.76 Joback Calculated Property
η 0.00 Pa×s 728.76 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Benzenepropanoic acid, hexyl ester. Benzenepropanoic acid, pentyl ester. 3-Phenylpropionic acid, 2-methylpentyl ester. 3-Phenylpropionic acid, 3-methylbutyl ester. 3-Phenylpropionic acid, 2-methylbutyl ester. Succinic acid, 8-chlorooctyl 3-phenylpropyl ester. Glutaric acid, 8-chlorooctyl 3-phenylpropyl ester. Benzenepropanoic acid, 3-phenylpropyl ester. Pimelic acid, 3-phenylpropyl undecyl ester. Sebacic acid, hexyl 3-phenylpropyl ester. Sebacic acid, heptyl 3-phenylpropyl ester. Sebacic acid, decyl 3-phenylpropyl ester. Sebacic acid, 3-phenylpropyl pentyl ester. Sebacic acid, octyl 3-phenylpropyl ester. Pimelic acid, decyl 3-phenylpropyl ester.

Find more compounds similar to 3-Phenylpropionic acid, 8-chlorooctyl ester.

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