Chemical Properties of Terephthalic acid, butyl 1,1,1-trifluoroprop-2-yl ester

Terephthalic acid, butyl 1,1,1-trifluoroprop-2-yl ester

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InChI
InChI=1S/C15H17F3O4/c1-3-4-9-21-13(19)11-5-7-12(8-6-11)14(20)22-10(2)15(16,17)18/h5-8,10H,3-4,9H2,1-2H3
InChI Key
AWDXPJBKAXOPIY-UHFFFAOYSA-N
Formula
C15H17F3O4
SMILES
CCCCOC(=O)c1ccc(C(=O)OC(C)C(F)(F)F)cc1
Molecular Weight1
318.29
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Physical Properties

Property Value Unit Source
Δf -873.67 kJ/mol Joback Calculated Property
Δfgas -1219.83 kJ/mol Joback Calculated Property
Δfus 32.13 kJ/mol Joback Calculated Property
Δvap 66.10 kJ/mol Joback Calculated Property
log10WS -4.82 Crippen Calculated Property
logPoct/wat 3.751 Crippen Calculated Property
McVol 218.640 ml/mol McGowan Calculated Property
Pc 1798.51 kPa Joback Calculated Property
Inp [1947.00; 1947.00]   Show Hide
Inp 1947.00 NIST
Inp 1947.00 NIST
Tboil 720.98 K Joback Calculated Property
Tc 915.14 K Joback Calculated Property
Tfus 431.26 K Joback Calculated Property
Vc 0.853 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [620.09; 688.88] J/mol×K [720.98; 915.14] Show Hide
Cp,gas 620.09 J/mol×K 720.98 Joback Calculated Property
Cp,gas 633.73 J/mol×K 753.34 Joback Calculated Property
Cp,gas 646.46 J/mol×K 785.70 Joback Calculated Property
Cp,gas 658.31 J/mol×K 818.06 Joback Calculated Property
Cp,gas 669.32 J/mol×K 850.42 Joback Calculated Property
Cp,gas 679.50 J/mol×K 882.78 Joback Calculated Property
Cp,gas 688.88 J/mol×K 915.14 Joback Calculated Property

Similar Compounds

Terephthalic acid, pentyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, hexyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, heptyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, dodecyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, nonyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, decyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, octyl 1,1,1-trifluoroprop-2-yl ester. Terephthalic acid, 1,1,1-trifluoroprop-2-yl undecyl ester. Terephthalic acid, butyl 2,2,2-trifluoroethyl ester. Terephthalic acid, propyl 1,1,1-trifluoroprop-2-yl ester. Dibutyl terephthalate. Terephthalic acid, butyl 2,2,3,3,3-pentafluoropropyl ester. Terephthalic acid, butyl 2-fluoroethyl ester. Terephthalic acid, pentyl 2,2,2-trifluoroethyl ester. Isophthalic acid, butyl isopropyl ester.

Find more compounds similar to Terephthalic acid, butyl 1,1,1-trifluoroprop-2-yl ester.

Sources

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