Chemical Properties of Octyl 4-chlorobutanoate

Octyl 4-chlorobutanoate

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InChI
InChI=1S/C12H23ClO2/c1-2-3-4-5-6-7-11-15-12(14)9-8-10-13/h2-11H2,1H3
InChI Key
JLYKWKRZFITWIT-UHFFFAOYSA-N
Formula
C12H23ClO2
SMILES
CCCCCCCCOC(=O)CCCCl
Molecular Weight1
234.76
Other Names
  • Butanoic acid, 4-chloro, octyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -195.69 kJ/mol Joback Calculated Property
Δfgas -551.55 kJ/mol Joback Calculated Property
Δfus 33.82 kJ/mol Joback Calculated Property
Δvap 55.85 kJ/mol Joback Calculated Property
logPoct/wat 3.91 Crippen Calculated Property
Pc 1793.94 kPa Joback Calculated Property
Tboil 587.68 K Joback Calculated Property
Tc 762.26 K Joback Calculated Property
Tfus 327.08 K Joback Calculated Property
Vc 0.78 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 496.42 J/mol×K 587.68 Joback Calculated Property
η 0.00 Pa×s 587.68 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 10
-CH3 1
-Cl 1
>C=O (nonring) 1

Similar Compounds

4-Chlorobutyric acid, pentadecyl ester. 4-Chlorobutyric acid, octadecyl ester. Undecyl 4-chlorobutanoate. Nonyl 4-chlorobutanoate. Decyl 4-chlorobutanoate. Tetradecyl 4-chlorobutanoate. Hexadecyl 4-chlorobutanoate. 4-Chlorobutyric acid, eicosyl ester. Heptyl 4-chlorobutanoate. 4-Chlorobutyric acid, 8-chlorooctyl ester. Hexyl 4-chlorobutanoate. Butanoic acid, 4-chloro, pentyl ester. Butyric acid, dodecyl ester. Butyric acid, pentadecyl ester. Butanoic acid, octyl ester.

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