Chemical Properties of Butyric acid, 2-phenyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester

Butyric acid, 2-phenyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI
InChI=1S/C15H14F8O2/c1-2-10(9-6-4-3-5-7-9)11(24)25-8-13(18,19)15(22,23)14(20,21)12(16)17/h3-7,10,12H,2,8H2,1H3
InChI Key
ZPVMNKRYAMXSJY-UHFFFAOYSA-N
Formula
C15H14F8O2
SMILES
CCC(C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1
Molecular Weight1
378.26
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Physical Properties

Property Value Unit Source
ΔfusH° 28.37 kJ/mol Joback Calculated Property
logPoct/wat 4.894 Crippen Calculated Property
McVol 220.050 ml/mol McGowan Calculated Property
Inp [1451.00; 1451.00]   Show Hide
Inp 1451.00 NIST
Inp 1451.00 NIST
Tboil 541.35 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [343.35; 744.82] 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 A-4.72980e+01
Coefficient B1.77872e+00
Coefficient C-1.38180e-03
Coefficient D3.95200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 343.35 J/mol×K 273.00 Calculated Property
Cp,gas 426.53 J/mol×K 353.78 Calculated Property
Cp,gas 497.15 J/mol×K 434.56 Calculated Property
Cp,gas 556.46 J/mol×K 515.33 Calculated Property
Cp,gas 605.71 J/mol×K 596.11 Calculated Property
Cp,gas 646.15 J/mol×K 676.89 Calculated Property
Cp,gas 679.03 J/mol×K 757.67 Calculated Property
Cp,gas 705.61 J/mol×K 838.44 Calculated Property
Cp,gas 727.12 J/mol×K 919.22 Calculated Property
Cp,gas 744.82 J/mol×K 1000.00 Calculated Property

Similar Compounds

Butyric acid, 2-phenyl-, 2,2,3,3-tetrafluoropropyl ester. Phenbutrazate. 1-Methyl-4-piperidyl cyclopentylphenylglycolate. Cyclopentyl-hydroxy-phenyl-acetic acid 1-methyl-pyrrolidin-3-yl ester. 1-Methyl-4-piperidyl cyclohexylphenylglycolate. 11-Ketoestradiol (enol), TMS. risperidone. 5-Methyluridine, 2',3',5'-tris-O-TBDMS. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TBDMS. Thymidine, 3'-O-TBDMS, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-TMS, 5'-O-cyclotetramethylene-isopropylsilyl. Thymidine, 5'-O-cyclotetramethylene-tertbutylsilyl. Hydrastine. Uridine, 2'-O-TBDMS, 3',5'-bis-O-TFA. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-cyclotetramethylene-isopropylsilyl.

Find more compounds similar to Butyric acid, 2-phenyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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