Chemical Properties of 5-Chlorovaleric acid, 3-methylphenyl ester

5-Chlorovaleric acid, 3-methylphenyl ester

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InChI
InChI=1S/C12H15ClO2/c1-10-5-4-6-11(9-10)15-12(14)7-2-3-8-13/h4-6,9H,2-3,7-8H2,1H3
InChI Key
RDYAPVUPQWREBE-UHFFFAOYSA-N
Formula
C12H15ClO2
SMILES
Cc1cccc(OC(=O)CCCCCl)c1
Molecular Weight1
226.70
Sources

Physical Properties

Property Value Unit Source
Δf -92.91 kJ/mol Joback Calculated Property
Δfgas -326.49 kJ/mol Joback Calculated Property
Δfus 27.47 kJ/mol Joback Calculated Property
Δvap 58.79 kJ/mol Joback Calculated Property
logPoct/wat 3.31 Crippen Calculated Property
Pc 2391.19 kPa Joback Calculated Property
Tboil 619.34 K Joback Calculated Property
Tc 830.22 K Joback Calculated Property
Tfus 366.02 K Joback Calculated Property
Vc 0.67 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 421.33 J/mol×K 619.34 Joback Calculated Property
η 0.00 Pa×s 619.34 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Valeric acid, 3-methylphenyl ester. 6-Chlorohexanoic acid, 3-methylphenyl ester. 5-Bromovaleric acid, 3-methylphenyl ester. Glutaric acid, di(3-methylphenyl) ester. Butanoic acid, 3-methylphenyl ester. Octanoic acid, 3-methylphenyl ester. Sebacic acid, di(3-methylphenyl) ester. Myristic acid, 3-methylphenyl ester. Nonoic acid, 3-methylphenyl ester. 4-Chlorobutyric acid, 3-methylphenyl ester. Valeric acid, 3,5-dimethylphenyl ester. 5-Bromovaleric acid, 3,5-dimethylphenyl ester. Glutaric acid, di(3,5-dimethylphenyl) ester. 4-Bromobutyric acid, 3-methylphenyl ester. Butyric acid, 3,5-dimethylphenyl ester.

Find more compounds similar to 5-Chlorovaleric acid, 3-methylphenyl ester.

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