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
Δfgas -1081.24 kJ/mol Relay (1.0) Calculated Property
Δfus 20.57 kJ/mol Joback Calculated Property
Δvap 69.24 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 2445.89 kPa Joback Calculated Property
Inp 1254.00 NIST
Tboil 490.16 K Relay (1.0) Calculated Property
Tc 649.90 K Relay (1.0) Calculated Property
Tfus 278.55 K Relay (1.0) Calculated Property

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [399.60; 467.66] J/mol×K [570.61; 764.95] Show Hide
Cp,gas 399.60 J/mol×K 570.61 Joback Calculated Property
Cp,gas 412.87 J/mol×K 603.00 Joback Calculated Property
Cp,gas 425.33 J/mol×K 635.39 Joback Calculated Property
Cp,gas 437.02 J/mol×K 667.78 Joback Calculated Property
Cp,gas 447.96 J/mol×K 700.17 Joback Calculated Property
Cp,gas 458.16 J/mol×K 732.56 Joback Calculated Property
Cp,gas 467.66 J/mol×K 764.95 Joback 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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