Chemical Properties of Butyric acid, 2-phenyl-, 1,1,1-trifluoroprop-2-yl ester

Butyric acid, 2-phenyl-, 1,1,1-trifluoroprop-2-yl ester

InChI
InChI=1S/C13H15F3O2/c1-3-11(10-7-5-4-6-8-10)12(17)18-9(2)13(14,15)16/h4-9,11H,3H2,1-2H3
InChI Key
YDRHIWSKEIHPHF-UHFFFAOYSA-N
Formula
C13H15F3O2
SMILES
CCC(C(=O)OC(C)C(F)(F)F)c1ccccc1
Molecular Weight1
260.25
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Physical Properties

Property Value Unit Source
ΔfusH° 22.62 kJ/mol Joback Calculated Property
ΔvapH° 64.28 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 3.674 Crippen Calculated Property
McVol 183.020 ml/mol McGowan Calculated Property
Inp [1264.00; 1264.00]   Show Hide
Inp 1264.00 NIST
Inp 1264.00 NIST
Tboil 498.25 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, 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 [466.04; 545.19] J/mol×K [575.64; 767.91] Show Hide
Cp,gas 466.04 J/mol×K 575.64 Joback Calculated Property
Cp,gas 481.58 J/mol×K 607.68 Joback Calculated Property
Cp,gas 496.13 J/mol×K 639.73 Joback Calculated Property
Cp,gas 509.73 J/mol×K 671.77 Joback Calculated Property
Cp,gas 522.41 J/mol×K 703.82 Joback Calculated Property
Cp,gas 534.22 J/mol×K 735.86 Joback Calculated Property
Cp,gas 545.19 J/mol×K 767.91 Joback Calculated Property

Similar Compounds

Butyric acid, 2-phenyl-, isopropyl ester. Butyric acid, 2-phenyl-, but-3-yn-2-yl ester. Butyric acid, 2-phenyl-, 3-methylbut-2-yl ester. Benzeneacetic acid, «alpha»-ethyl-, ethyl ester. Butyric acid, 2-phenyl-, butyl ester. Butyric acid, 2-phenyl-, 2,2,3,3-tetrafluoropropyl ester. Butyric acid, 2-phenyl-, pent-2-yl ester. Butyric acid, 2-phenyl-, isobutyl ester. Butyric acid, 2-phenyl-, hex-4-yn-3-yl ester. Butyric acid, 2-phenyl-, 4-methyl-2-pentyl ester. Butyric acid, 2-phenyl-, pentyl ester. Butyric acid, 2-phenyl-, hept-2-yl ester. Butyric acid, 2-phenyl-, dec-2-yl ester. Butyric acid, 2-phenyl-, hexyl ester. Butyric acid, 2-phenyl-, heptyl ester.

Find more compounds similar to Butyric acid, 2-phenyl-, 1,1,1-trifluoroprop-2-yl ester.

Sources

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