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

Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methylbutyl ester

InChI
InChI=1S/C12H19F3O4/c1-4-8(2)7-18-10(16)5-6-11(17)19-9(3)12(13,14)15/h8-9H,4-7H2,1-3H3
InChI Key
QMRCUCNKNFELMG-UHFFFAOYSA-N
Formula
C12H19F3O4
SMILES
CCC(C)COC(=O)CCC(=O)OC(C)C(F)(F)F
Molecular Weight1
284.27
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Physical Properties

Property Value Unit Source
ΔfusH° 30.35 kJ/mol Joback Calculated Property
ΔvapH° 67.21 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.850 Crippen Calculated Property
McVol 200.130 ml/mol McGowan Calculated Property
Pc 1652.46 kPa Joback Calculated Property
Inp [1340.00; 1340.00]   Show Hide
Inp 1340.00 NIST
Inp 1340.00 NIST
Tboil 498.62 K Relay (1.0) Calculated Property
Tc 645.96 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Enthalpy of formation 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [315.23; 678.39] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.32340e+01
Coefficient B1.20726e+00
Coefficient C-6.67200e-04
Coefficient D1.05100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 315.23 J/mol×K 273.00 Calculated Property
Cp,gas 381.48 J/mol×K 353.78 Calculated Property
Cp,gas 440.49 J/mol×K 434.56 Calculated Property
Cp,gas 492.57 J/mol×K 515.33 Calculated Property
Cp,gas 538.07 J/mol×K 596.11 Calculated Property
Cp,gas 577.31 J/mol×K 676.89 Calculated Property
Cp,gas 610.64 J/mol×K 757.67 Calculated Property
Cp,gas 638.37 J/mol×K 838.44 Calculated Property
Cp,gas 660.84 J/mol×K 919.22 Calculated Property
Cp,gas 678.39 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 1,1,1-trifluoroprop-2-yl 2-ethylbutyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methylpentyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-methylbutyl ester. Succinic acid, 3-methylbutyl 1,1,1-trifluoro-2-propyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-ethylbutyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4,4-trimethylpentyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-methylpentyl ester. Succinic acid, cyclohexylmethyl 1,1,1-trifluoroprop-2-yl ester. Succinic acid, 3-methylbut-2-yl 2-methylbutyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,4,4-trimethylpentyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-ethylhexyl ester. Succinic acid, but-3-yn-2-yl 2-methylbutyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3-methylpentyl ester. Butanedioic acid, ethyl-(2-methyl-1-butyl) ester. Glutaric acid, cyclohexylmethyl 1,1,1-trifluoroprop-2-yl ester.

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

Sources

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