Chemical Properties of 4-Chlorobutyric acid, 3,5-dimethylphenyl ester

4-Chlorobutyric acid, 3,5-dimethylphenyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C12H15ClO2/c1-9-6-10(2)8-11(7-9)15-12(14)4-3-5-13/h6-8H,3-5H2,1-2H3
InChI Key
BWWVMEDTGZFRCA-UHFFFAOYSA-N
Formula
C12H15ClO2
SMILES
Cc1cc(C)cc(OC(=O)CCCCl)c1
Molecular Weight1
226.70
Sources

Physical Properties

Property Value Unit Source
Δf -102.54 kJ/mol Joback Calculated Property
Δfgas -337.96 kJ/mol Joback Calculated Property
Δfus 27.08 kJ/mol Joback Calculated Property
Δvap 59.45 kJ/mol Joback Calculated Property
logPoct/wat 3.23 Crippen Calculated Property
Pc 2356.49 kPa Joback Calculated Property
Tboil 624.32 K Joback Calculated Property
Tc 836.12 K Joback Calculated Property
Tfus 378.54 K Joback Calculated Property
Vc 0.67 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 420.60 J/mol×K 624.32 Joback Calculated Property
η 0.00 Pa×s 624.32 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

4-Chlorobutyric acid, 3-methylphenyl ester. Butyric acid, 3,5-dimethylphenyl ester. Valeric acid, 3,5-dimethylphenyl ester. 4-Bromobutyric acid, 3,5-dimethylphenyl ester. Butanoic acid, 3-methylphenyl ester. 4-Chlorobutyric acid, 3,4-dimethylphenyl ester. Glutaric acid, di(3,5-dimethylphenyl) ester. 5-Bromovaleric acid, 3,5-dimethylphenyl ester. Cyclopropanecarboxylic acid, 3,5-dimethylphenyl ester. Octanoic acid, 3,5-dimethylphenyl ester. Lauric acid, 3,5-dimethylphenyl ester. Sebacic acid, di(3,5-dimethylphenyl) ester. 4-Chlorobutyric acid, 3-ethylphenyl ester. 5-Chlorovaleric acid, 3-methylphenyl ester. Valeric acid, 3-methylphenyl ester.

Find more compounds similar to 4-Chlorobutyric acid, 3,5-dimethylphenyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.