Chemical Properties of Succinic acid, 3-chlorophenyl 3,3-dimethylbut-2-yl ester

Succinic acid, 3-chlorophenyl 3,3-dimethylbut-2-yl ester

InChI
InChI=1S/C16H21ClO4/c1-11(16(2,3)4)20-14(18)8-9-15(19)21-13-7-5-6-12(17)10-13/h5-7,10-11H,8-9H2,1-4H3
InChI Key
QUPDTWCKLOSRJN-UHFFFAOYSA-N
Formula
C16H21ClO4
SMILES
CC(OC(=O)CCC(=O)Oc1cccc(Cl)c1)C(C)(C)C
Molecular Weight1
312.79
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Physical Properties

Property Value Unit Source
ΔfusH° 32.85 kJ/mol Joback Calculated Property
IE 8.77 eV Relay (1.0) Calculated Property
log10WS -4.75 Relay (1.0) Calculated Property
logPoct/wat 4.003 Crippen Calculated Property
McVol 239.660 ml/mol McGowan Calculated Property
Inp [2079.00; 2079.00]   Show Hide
Inp 2079.00 NIST
Inp 2079.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 [668.06; 740.58] J/mol×K [747.54; 960.90] Show Hide
Cp,gas 668.06 J/mol×K 747.54 Joback Calculated Property
Cp,gas 683.01 J/mol×K 783.10 Joback Calculated Property
Cp,gas 696.76 J/mol×K 818.66 Joback Calculated Property
Cp,gas 709.36 J/mol×K 854.22 Joback Calculated Property
Cp,gas 720.83 J/mol×K 889.78 Joback Calculated Property
Cp,gas 731.23 J/mol×K 925.34 Joback Calculated Property
Cp,gas 740.58 J/mol×K 960.90 Joback Calculated Property
η [0.0000494; 0.0013621] Pa×s [411.02; 747.54] Show Hide
η 0.0013621 Pa×s 411.02 Joback Calculated Property
η 0.0005623 Pa×s 467.11 Joback Calculated Property
η 0.0002807 Pa×s 523.19 Joback Calculated Property
η 0.0001602 Pa×s 579.28 Joback Calculated Property
η 0.0001010 Pa×s 635.37 Joback Calculated Property
η 0.0000686 Pa×s 691.45 Joback Calculated Property
η 0.0000494 Pa×s 747.54 Joback Calculated Property

Similar Compounds

Succinic acid, 3-methylbut-2-yl 3-chlorophenyl ester. Succinic acid, 2,3-dichlorophenyl 3,3-dimethylbut-2-yl ester. Succinic acid, 3-chlorophenyl 2,4-dimethylpent-3-yl ester. Succinic acid, 3-chlorophenyl 2-methylpent-3-yl ester. Succinic acid, 3-methylbut-2-yl 3,5-dichlorophenyl ester. Succinic acid, 3-methylbut-2-yl 2-chlorophenyl ester. Succinic acid, 3-methylbut-2-yl 2,3-dichlorophenyl ester. Succinic acid, 2-fluorophenyl 3,3-dimethylbut-2-yl ester. Succinic acid, 3-chlorophenyl neopentyl ester. Succinic acid, 3-chlorophenyl 4-methylpent-2-yl ester. Succinic acid, 3-methylbut-2-yl 2,4-dichlorophenyl ester. Succinic acid, 3-chlorophenyl 3-hexyl ester. Succinic acid, 3-methylbut-2-yl 2,4,5-trichlorophenyl ester. Glutaric acid, 3-methylbut-2-yl 3-chlorophenyl ester. Succinic acid, 3-chlorophenyl 4-heptyl ester.

Find more compounds similar to Succinic acid, 3-chlorophenyl 3,3-dimethylbut-2-yl ester.

Sources

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