Chemical Properties of 4-Chlorobutyric acid, 2,3,4,6-tetrachlorophenyl ester

4-Chlorobutyric acid, 2,3,4,6-tetrachlorophenyl ester

InChI
InChI=1S/C10H7Cl5O2/c11-3-1-2-7(16)17-10-6(13)4-5(12)8(14)9(10)15/h4H,1-3H2
InChI Key
WFRIAUUGCHUAOK-UHFFFAOYSA-N
Formula
C10H7Cl5O2
SMILES
O=C(CCCCl)Oc1c(Cl)cc(Cl)c(Cl)c1Cl
Molecular Weight1
336.43
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δfus 39.49 kJ/mol Joback Calculated Property
IE 9.09 eV Relay (1.0) Calculated Property
log10WS -5.67 Relay (1.0) Calculated Property
logPoct/wat 5.225 Crippen Calculated Property
McVol 196.640 ml/mol McGowan Calculated Property
Inp [2151.00; 2151.00]   Show Hide
Inp 2151.00 NIST
Inp 2151.00 NIST
Tboil 581.92 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [408.02; 448.73] J/mol×K [720.37; 952.20] Show Hide
Cp,gas 408.02 J/mol×K 720.37 Joback Calculated Property
Cp,gas 416.59 J/mol×K 759.01 Joback Calculated Property
Cp,gas 424.43 J/mol×K 797.65 Joback Calculated Property
Cp,gas 431.56 J/mol×K 836.28 Joback Calculated Property
Cp,gas 437.98 J/mol×K 874.92 Joback Calculated Property
Cp,gas 443.70 J/mol×K 913.56 Joback Calculated Property
Cp,gas 448.73 J/mol×K 952.20 Joback Calculated Property
η [0.0001325; 0.0007337] Pa×s [470.89; 720.37] Show Hide
η 0.0007337 Pa×s 470.89 Joback Calculated Property
η 0.0004913 Pa×s 512.47 Joback Calculated Property
η 0.0003495 Pa×s 554.05 Joback Calculated Property
η 0.0002607 Pa×s 595.63 Joback Calculated Property
η 0.0002020 Pa×s 637.21 Joback Calculated Property
η 0.0001615 Pa×s 678.79 Joback Calculated Property
η 0.0001325 Pa×s 720.37 Joback Calculated Property

Similar Compounds

4-Chlorobutyric acid, 2,4,5-trichlorophenyl ester. 4-Bromobutyric acid, 2,3,4,6-tetrachlorophenyl ester. 6-Chlorohexanoic acid, 2,3,4,6-tetrachlorophenyl ester. 4-Chlorobutyric acid, 2,3-dichlorophenyl ester. Succinic acid, di(2,3,4,6-tetrachlorophenyl) ester. Dodecanoic acid, 2,3,4,6-tetrachlorophenyl ester. Nonanoic acid, 2,3,4,6-tetrachlorophenyl ester. Glutaric acid, di(2,3,6-trichlorophenyl) ester. Isovaleric acid, 2,3,4,6-tetrachlorophenyl ester. Cyclopropanecarboxylic acid, 2,3,4,6-tetrachlorophenyl ester. 4-Chlorobutyric acid, 3,4-dichlorophenyl ester. Adipic acid, di(2,3,6-trichlorophenyl) ester. Glutaric acid, 2,4,6-trichlorophenyl 2,3,5-trichlorophenyl ester. 6-Bromohexanoic acid, 2,3,4,6-tetrachlorophenyl ester. 6-Chlorohexanoic acid, 2,4,5-trichlorophenyl ester.

Find more compounds similar to 4-Chlorobutyric acid, 2,3,4,6-tetrachlorophenyl ester.

Sources

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.
These property values are available through the Cheméo API. A free account gives you an access key.