Chemical Properties of Glutaric acid, 3-chlorophenyl 2-methylhex-3-yl ester

Glutaric acid, 3-chlorophenyl 2-methylhex-3-yl ester

InChI
InChI=1S/C18H25ClO4/c1-4-7-16(13(2)3)23-18(21)11-6-10-17(20)22-15-9-5-8-14(19)12-15/h5,8-9,12-13,16H,4,6-7,10-11H2,1-3H3
InChI Key
QDPZQWKYQONOQD-UHFFFAOYSA-N
Formula
C18H25ClO4
SMILES
CCCC(OC(=O)CCCC(=O)Oc1cccc(Cl)c1)C(C)C
Molecular Weight1
340.84
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
ΔfusH° 38.75 kJ/mol Joback Calculated Property
IE 8.64 eV Relay (1.0) Calculated Property
log10WS -4.92 Relay (1.0) Calculated Property
logPoct/wat 4.784 Crippen Calculated Property
McVol 267.840 ml/mol McGowan Calculated Property
Inp [2273.00; 2273.00]   Show Hide
Inp 2273.00 NIST
Inp 2273.00 NIST
Tboil 629.40 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 [789.48; 861.84] J/mol×K [832.03; 1040.64] Show Hide
Cp,gas 789.48 J/mol×K 832.03 Joback Calculated Property
Cp,gas 804.30 J/mol×K 866.80 Joback Calculated Property
Cp,gas 817.99 J/mol×K 901.57 Joback Calculated Property
Cp,gas 830.57 J/mol×K 936.33 Joback Calculated Property
Cp,gas 842.05 J/mol×K 971.10 Joback Calculated Property
Cp,gas 852.47 J/mol×K 1005.87 Joback Calculated Property
Cp,gas 861.84 J/mol×K 1040.64 Joback Calculated Property
η [0.0000529; 0.0007660] Pa×s [475.80; 832.03] Show Hide
η 0.0007660 Pa×s 475.80 Joback Calculated Property
η 0.0003832 Pa×s 535.17 Joback Calculated Property
η 0.0002201 Pa×s 594.54 Joback Calculated Property
η 0.0001398 Pa×s 653.91 Joback Calculated Property
η 0.0000958 Pa×s 713.29 Joback Calculated Property
η 0.0000696 Pa×s 772.66 Joback Calculated Property
η 0.0000529 Pa×s 832.03 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-methylpent-3-yl 3-chlorophenyl ester. Glutaric acid, 3-chlorophenyl 2,4-dimethylpent-3-yl ester. Glutaric acid, 2,3-dichlorophenyl 2-methylhex-3-yl ester. Glutaric acid, 3-chlorophenyl trans-4-tert-butylcyclohexyl ester. Glutaric acid, 1-cyclopentylethyl 3-chlorophenyl ester. Glutaric acid, 3-chlorophenyl 3-hexyl ester. Glutaric acid, 2-methylpent-3-yl 2,3-dichlorophenyl ester. Glutaric acid, 2-norbornyl 3-chlorophenyl ester. Glutaric acid, 3-chlorophenyl 4-methylpent-2-yl ester. Glutaric acid, 3-chlorophenyl hept-4-yl ester. Glutaric acid, 2-methylpent-3-yl 2-chlorophenyl ester. Glutaric acid, 2-methylpent-3-yl 2,5-dichlorophenyl ester. Pimelic acid, 3-chlorophenyl 4-methyl-2-pentyl ester. Glutaric acid, 3-chlorophenyl 3-octyl ester. Glutaric acid, 2,3-dichlorophenyl 2,4-dimethylpent-3-yl ester.

Find more compounds similar to Glutaric acid, 3-chlorophenyl 2-methylhex-3-yl 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.