Chemical Properties of 1-Phenoxypropan-2-yl trifluoroacetate

1-Phenoxypropan-2-yl trifluoroacetate

InChI
InChI=1S/C11H11F3O3/c1-8(17-10(15)11(12,13)14)7-16-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChI Key
IMTYBMZPGKODON-UHFFFAOYSA-N
Formula
C11H11F3O3
SMILES
CC(COc1ccccc1)OC(=O)C(F)(F)F
Molecular Weight1
248.20
Other Names
  • 2-Phenoxy-1-methylethyl trifluoroacetate
  • Phenoxyisopropanyl trifluoroacetate
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Physical Properties

Property Value Unit Source
ω 0.5192 Relay (1.0) Calculated Property
ΔfH°gas -1081.24 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.15 kJ/mol Joback Calculated Property
ΔvapH° 69.66 kJ/mol Relay (1.0) Calculated Property
IE 9.07 eV Relay (1.0) Calculated Property
log10WS -2.23 Relay (1.0) Calculated Property
logPoct/wat 2.559 Crippen Calculated Property
McVol 160.710 ml/mol McGowan Calculated Property
Pc 2349.64 kPa Joback Calculated Property
Inp 1254.00 NIST
Tboil 490.16 K Relay (1.0) Calculated Property
Tc 651.71 K Relay (1.0) Calculated Property
Tfus 277.28 K Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [236.14; 518.13] 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 A2.01100e+00
Coefficient B1.01902e+00
Coefficient C-6.24400e-04
Coefficient D1.21500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 236.14 J/mol×K 273.00 Calculated Property
Cp,gas 289.75 J/mol×K 353.78 Calculated Property
Cp,gas 336.89 J/mol×K 434.56 Calculated Property
Cp,gas 377.95 J/mol×K 515.33 Calculated Property
Cp,gas 413.32 J/mol×K 596.11 Calculated Property
Cp,gas 443.37 J/mol×K 676.89 Calculated Property
Cp,gas 468.49 J/mol×K 757.67 Calculated Property
Cp,gas 489.07 J/mol×K 838.44 Calculated Property
Cp,gas 505.49 J/mol×K 919.22 Calculated Property
Cp,gas 518.13 J/mol×K 1000.00 Calculated Property

Similar Compounds

1-Phenoxypropan-2-yl acetate. Trifluoroaceic acid, 2-phenoxypropyl ester. 1,2-Diacetoxy-3-(2-methoxyphenoxy)propane. 2-(3,4-Dichlorophenoxy)-1-methylethyl 2,2-dichloropropanoate. Propranolol desamino hydroxy, acetylated. Toliprolol desamino hydroxy, acetylated. Oxirane, (phenoxymethyl)-. Oxirane, 2,2'-[1,3-phenylenebis(oxymethylene)]bis-. Propranolol desamino dihydroxy, acetylated. 1-Phenoxypropan-2-ol. Trimethyl-(1-methyl-2-phenoxy-ethoxy)silane. MEXILETINE, M (DESAMINO-HO-), AC. p-Chlorophenyl 2,3-epoxypropyl ether. Toliprolol desamino dihydroxy, acetylated. 3-Phenoxypropyl 2,2,2-trifluoroacetate.

Find more compounds similar to 1-Phenoxypropan-2-yl trifluoroacetate.

Sources

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