Chemical Properties of Succinic acid, 1,1,1-trifluoroprop-2-yl 3-chlorophenyl ester

Succinic acid, 1,1,1-trifluoroprop-2-yl 3-chlorophenyl ester

InChI
InChI=1S/C13H12ClF3O4/c1-8(13(15,16)17)20-11(18)5-6-12(19)21-10-4-2-3-9(14)7-10/h2-4,7-8H,5-6H2,1H3
InChI Key
PDKNAXJOWNBFCK-UHFFFAOYSA-N
Formula
C13H12ClF3O4
SMILES
CC(OC(=O)CCC(=O)Oc1cccc(Cl)c1)C(F)(F)F
Molecular Weight1
324.68
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Physical Properties

Property Value Unit Source
Δfus 34.32 kJ/mol Joback Calculated Property
IE 9.12 eV Relay (1.0) Calculated Property
log10WS -4.08 Relay (1.0) Calculated Property
logPoct/wat 3.520 Crippen Calculated Property
McVol 202.700 ml/mol McGowan Calculated Property
Inp [1732.00; 1732.00]   Show Hide
Inp 1732.00 NIST
Inp 1732.00 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 [532.95; 593.12] J/mol×K [676.71; 873.93] Show Hide
Cp,gas 532.95 J/mol×K 676.71 Joback Calculated Property
Cp,gas 545.22 J/mol×K 709.58 Joback Calculated Property
Cp,gas 556.56 J/mol×K 742.45 Joback Calculated Property
Cp,gas 567.00 J/mol×K 775.32 Joback Calculated Property
Cp,gas 576.55 J/mol×K 808.19 Joback Calculated Property
Cp,gas 585.25 J/mol×K 841.06 Joback Calculated Property
Cp,gas 593.12 J/mol×K 873.93 Joback Calculated Property

Similar Compounds

Succinic acid, 3-chlorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3,5-dichlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2-chlorophenyl ester. Succinic acid, 2,3-dichlorophenyl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-chlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4,5-trichlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 4-chloro-2-methoxyphenyl ester. Succinic acid, but-3-yn-2-yl 3-chlorophenyl ester. Succinic acid, 2,3-dichlorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2,6-dichlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3-methoxyphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,3-dichlorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-chlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3-fluorophenyl ester.

Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl 3-chlorophenyl ester.

Sources

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