Chemical Properties of 4-Phenylbutan-2-ol trifluoroacetate

4-Phenylbutan-2-ol trifluoroacetate

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InChI
InChI=1S/C12H13F3O2/c1-9(17-11(16)12(13,14)15)7-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChI Key
RCNPYDZVSNUILB-UHFFFAOYSA-N
Formula
C12H13F3O2
SMILES
CC(CCc1ccccc1)OC(=O)C(F)(F)F
Molecular Weight1
246.23
Other Names
  • 2-Butanol, 4-phenyl-O-trifluoroacetyl-
  • 2-trifluoroacetyloxy-4-phenylbutane
  • 4-Phenyl-2-butanol trifluoroacetate
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Physical Properties

Property Value Unit Source
Δf -655.38 kJ/mol Joback Calculated Property
Δfgas -901.64 kJ/mol Joback Calculated Property
Δfus 21.97 kJ/mol Joback Calculated Property
Δvap 49.60 kJ/mol Joback Calculated Property
log10WS -3.59 Crippen Calculated Property
logPoct/wat 3.113 Crippen Calculated Property
McVol 168.930 ml/mol McGowan Calculated Property
Pc 2265.42 kPa Joback Calculated Property
Inp 1229.00 NIST
Tboil 571.07 K Joback Calculated Property
Tc 764.43 K Joback Calculated Property
Tfus 312.77 K Joback Calculated Property
Vc 0.660 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [422.21; 495.17] J/mol×K [571.07; 764.43] Show Hide
Cp,gas 422.21 J/mol×K 571.07 Joback Calculated Property
Cp,gas 436.46 J/mol×K 603.30 Joback Calculated Property
Cp,gas 449.83 J/mol×K 635.52 Joback Calculated Property
Cp,gas 462.35 J/mol×K 667.75 Joback Calculated Property
Cp,gas 474.05 J/mol×K 699.97 Joback Calculated Property
Cp,gas 484.98 J/mol×K 732.20 Joback Calculated Property
Cp,gas 495.17 J/mol×K 764.43 Joback Calculated Property

Similar Compounds

Benzenepropanol, «alpha»-methyl-, acetate. Succinic acid, 3-methylbut-2-yl 3-phenylpropyl ester. Glutaric acid, 3-methylbut-2-yl 3-phenylpropyl ester. Fumaric acid, 3-phenylpropyl 3-methylbut-2-yl ester. 4-Phenyl-2-butanol. Succinic acid, 2-methylpent-3-yl 3-phenylpropyl ester. 3-Phenylpropionic acid, 3-methylbut-2-yl ester. Dimethyl phenylethyl carbinyl acetate. Glutaric acid, 2-methylpent-3-yl 3-phenylpropyl ester. Glutaric acid, hept-2-yl 3-phenylpropyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-phenylpropyl ester. Glutaric acid, dec-2-yl 3-phenylpropyl ester. Glutaric acid, isobutyl 3-phenylpropyl ester. Succinic acid, hept-2-yl 3-phenylpropyl ester. Succinic acid, dec-2-yl 3-phenylpropyl ester.

Find more compounds similar to 4-Phenylbutan-2-ol trifluoroacetate.

Sources

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