Chemical Properties of Hexanoic acid, 3,5,5-trimethyl-, 2,3-dichlorophenyl ester

Hexanoic acid, 3,5,5-trimethyl-, 2,3-dichlorophenyl ester

InChI
InChI=1S/C15H20Cl2O2/c1-10(9-15(2,3)4)8-13(18)19-12-7-5-6-11(16)14(12)17/h5-7,10H,8-9H2,1-4H3
InChI Key
GPORBFFXACEAEP-UHFFFAOYSA-N
Formula
C15H20Cl2O2
SMILES
CC(CC(=O)Oc1cccc(Cl)c1Cl)CC(C)(C)C
Molecular Weight1
303.22
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Physical Properties

Property Value Unit Source
ΔfusH° 29.70 kJ/mol Joback Calculated Property
log10WS -6.04 Relay (1.0) Calculated Property
logPoct/wat 5.361 Crippen Calculated Property
McVol 230.370 ml/mol McGowan Calculated Property
Inp [1968.00; 1968.00]   Show Hide
Inp 1968.00 NIST
Inp 1968.00 NIST
Tfus 319.52 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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, Ionization energy 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 [600.89; 677.17] J/mol×K [708.85; 927.15] Show Hide
Cp,gas 600.89 J/mol×K 708.85 Joback Calculated Property
Cp,gas 616.21 J/mol×K 745.23 Joback Calculated Property
Cp,gas 630.41 J/mol×K 781.62 Joback Calculated Property
Cp,gas 643.56 J/mol×K 818.00 Joback Calculated Property
Cp,gas 655.71 J/mol×K 854.38 Joback Calculated Property
Cp,gas 666.89 J/mol×K 890.77 Joback Calculated Property
Cp,gas 677.17 J/mol×K 927.15 Joback Calculated Property
η [0.0000769; 0.0014046] Pa×s [399.86; 708.85] Show Hide
η 0.0014046 Pa×s 399.86 Joback Calculated Property
η 0.0006567 Pa×s 451.36 Joback Calculated Property
η 0.0003588 Pa×s 502.86 Joback Calculated Property
η 0.0002193 Pa×s 554.36 Joback Calculated Property
η 0.0001457 Pa×s 605.85 Joback Calculated Property
η 0.0001033 Pa×s 657.35 Joback Calculated Property
η 0.0000769 Pa×s 708.85 Joback Calculated Property

Similar Compounds

Hexanoic acid, 3,5,5-trimethyl-, 3-chlorophenyl ester. 2-Methylpentanoic acid, 2,3-dichlorophenyl ester. Glutaric acid, 2,3-dichlorophenyl 3,7-dimethyloctyl ester. Hexanoic acid, 3,5,5-trimethyl-, 2-chloro-6-fluorophenyl ester. Sebacic acid, 2,3-dichlorophenyl isohexyl ester. Glutaric acid, 2,3-dichlorophenyl cis-4-tert-butylcyclohexyl ester. Glutaric acid, 2,3-dichlorophenyl trans-4-tert-butylcyclohexyl ester. Sebacic acid, 2,3-dichlorophenyl ethyl ester. 2-Ethylbutyric acid, 2,3-dichlorophenyl ester. Sebacic acid, butyl 2,3-dichlorophenyl ester. Glutaric acid, 2,3-dichlorophenyl 3-methylbutyl ester. Glutaric acid, 2,3-dichlorophenyl 3-methyl-5-methoxypentyl ester. Glutaric acid, 2,3-dichlorophenyl isohexyl ester. Glutaric acid, 2,3-dichlorophenyl 2-ethylhexyl ester. 3-Cyclopentylpropionic acid, 2,4,5-trichlorophenyl ester.

Find more compounds similar to Hexanoic acid, 3,5,5-trimethyl-, 2,3-dichlorophenyl ester.

Sources

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