Chemical Properties of Succinic acid, 2-methylhex-3-yl 4-methylthiophenyl ester

Succinic acid, 2-methylhex-3-yl 4-methylthiophenyl ester

InChI
InChI=1S/C18H26O4S/c1-5-6-16(13(2)3)22-18(20)12-11-17(19)21-14-7-9-15(23-4)10-8-14/h7-10,13,16H,5-6,11-12H2,1-4H3
InChI Key
RXLVZHZTYHAXSP-UHFFFAOYSA-N
Formula
C18H26O4S
SMILES
CCCC(OC(=O)CCC(=O)Oc1ccc(SC)cc1)C(C)C
Molecular Weight1
338.46
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Physical Properties

Property Value Unit Source
ΔfusH° 41.85 kJ/mol Joback Calculated Property
logPoct/wat 4.462 Crippen Calculated Property
McVol 271.950 ml/mol McGowan Calculated Property
Inp [2456.00; 2456.00]   Show Hide
Inp 2456.00 NIST
Inp 2456.00 NIST
Tboil 641.23 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, Ionization energy, Log10 of Water solubility in mol/l 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 [809.56; 880.14] J/mol×K [827.44; 1041.01] Show Hide
Cp,gas 809.56 J/mol×K 827.44 Joback Calculated Property
Cp,gas 824.69 J/mol×K 863.04 Joback Calculated Property
Cp,gas 838.44 J/mol×K 898.63 Joback Calculated Property
Cp,gas 850.85 J/mol×K 934.23 Joback Calculated Property
Cp,gas 861.93 J/mol×K 969.82 Joback Calculated Property
Cp,gas 871.68 J/mol×K 1005.42 Joback Calculated Property
Cp,gas 880.14 J/mol×K 1041.01 Joback Calculated Property

Similar Compounds

Glutaric acid, 2-methylhex-3-yl 2-(methylthio)phenyl ester. Succinic acid, 2-methylpent-3-yl 3-methoxyphenyl ester. Succinic acid, 2-fluorophenyl adamant-2-yl ester. Succinic acid, 2-fluorophenyl trans-4-methylcyclohexyl ester. Succinic acid, 2-fluorophenyl cis-4-methylcyclohexyl ester. Glutaric acid, 2-fluorophenyl 2-methylhex-3-yl ester. Succinic acid, 2-methylpent-3-yl 4-acetylphenyl ester. Succinic acid, 2-fluorophenyl 2-methylpent-3-yl ester. Succinic acid, 3-chlorophenyl adamant-2-yl ester. Glutaric acid, 3-chlorophenyl 2-methylhex-3-yl ester. Succinic acid, 2-methylpent-3-yl 3-fluorophenyl ester. Succinic acid, 2-methylpent-3-yl 4-cyanophenyl ester. Succinic acid, 2-methylpent-3-yl 2-methylphenyl ester. Succinic acid, 2-methylpent-3-yl 2-methoxyphenyl ester. Succinic acid, 2-fluorophenyl trans-4-tert-butylcyclohexyl ester.

Find more compounds similar to Succinic acid, 2-methylhex-3-yl 4-methylthiophenyl ester.

Sources

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