Chemical Properties of 4-Chlorobenzoic acid, oct-3-en-2-yl ester

4-Chlorobenzoic acid, oct-3-en-2-yl ester

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InChI
InChI=1S/C15H19ClO2/c1-3-4-5-6-7-12(2)18-15(17)13-8-10-14(16)11-9-13/h6-12H,3-5H2,1-2H3/b7-6+
InChI Key
CKYPWBNNZZHCOB-VOTSOKGWSA-N
Formula
C15H19ClO2
SMILES
CCCCC=CC(C)OC(=O)c1ccc(Cl)cc1
Molecular Weight1
266.76
Sources

Physical Properties

Property Value Unit Source
Δf 10.13 kJ/mol Joback Calculated Property
Δfgas -276.47 kJ/mol Joback Calculated Property
Δfus 31.92 kJ/mol Joback Calculated Property
Δvap 65.03 kJ/mol Joback Calculated Property
logPoct/wat 4.63 Crippen Calculated Property
Pc 1935.54 kPa Joback Calculated Property
Tboil 691.70 K Joback Calculated Property
Tc 904.77 K Joback Calculated Property
Tfus 379.75 K Joback Calculated Property
Vc 0.81 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 553.39 J/mol×K 691.7 Joback Calculated Property
η 0.00 Pa×s 691.7 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>CH- 1
-Cl 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 3
=CH- 2
-CH3 2
>C=O (nonring) 1

Similar Compounds

4-Chlorobenzoic acid, undec-2-enyl ester. p-Toluic acid, oct-3-en-2-yl ester. Benzoic acid, 4-chloro, (E)-2-butenyl ester. 4-Chlorobenzoic acid, 3-methylbut-2-enyl ester. 4-Ethylbenzoic acid, oct-3-en-2-yl ester. 4-Fluorobenzoic acid. oct-3-en-2-yl ester. 4-Bromobenzoic acid, oct-3-en-2-yl ester. Benzoic acid, 4-chloro-, 1-methylethyl ester. 4-Chlorobenzoic acid, pent-2-en-4-ynyl ester. 4-Chlorobenzoic acid, 2-propenyl ester. m-Toluic acid, oct-3-en-2-yl ester. 2-Chlorobenzoic acid, oct-3-en-2-yl ester. 4-(Trifluoromethyl)benzoic acid, oct-3-en-2-yl ester. 3-Fluorobenzoic acid, oct-3-en-2-yl ester. 3-Bromobenzoic acid, oct-3-en-2-yl ester.

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