Chemical Properties of Phenylacetic acid, 4-chloro-, butyl ester

Phenylacetic acid, 4-chloro-, butyl ester

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InChI
InChI=1S/C12H15ClO2/c1-2-3-8-15-12(14)9-10-4-6-11(13)7-5-10/h4-7H,2-3,8-9H2,1H3
InChI Key
RYVAYVLGDLRUIN-UHFFFAOYSA-N
Formula
C12H15ClO2
SMILES
CCCCOC(=O)Cc1ccc(Cl)cc1
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 3.23 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
-CH3 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 4
-Cl 1
>C=O (nonring) 1

Similar Compounds

Phenylacetic acid, 4-chloro-, propyl ester. Phenylacetic acid, 4-chloro-, dodecyl ester. Phenylacetic acid, 4-chloro-, undecyl ester. Phenylacetic acid, 4-chloro-, hexadecyl ester. Phenylacetic acid, 4-chloro-, tridecyl ester. Phenylacetic acid, 4-chloro-, tetradecyl ester. Phenylacetic acid, 4-chloro-, pentadecyl ester. Phenylacetic acid, 4-chloro-, heptadecyl ester. Benzeneacetic acid, butyl ester. Benzeneacetic acid, 4-chloro-, methyl ester. Acetic acid, phenyl-, isopentyl ester. Pentyl phenylacetate. Benzeneacetic acid, hexyl ester. Benzeneacetic acid, 4-chloro-, but-3-yn-2-yl ester. Benzeneacetic acid, heptyl ester.

Find more compounds similar to Phenylacetic acid, 4-chloro-, butyl ester.

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