Chemical Properties of 1,1,1-Tris(hydroxymethyl)propane, tri(trifluoroacetate)

1,1,1-Tris(hydroxymethyl)propane, tri(trifluoroacetate)

InChI
InChI=1S/C12H11F9O6/c1-2-9(3-25-6(22)10(13,14)15,4-26-7(23)11(16,17)18)5-27-8(24)12(19,20)21/h2-5H2,1H3
InChI Key
AEKOLUVECIUHSH-UHFFFAOYSA-N
Formula
C12H11F9O6
SMILES
CCC(COC(=O)C(F)(F)F)(COC(=O)C(F)(F)F)COC(=O)C(F)(F)F
Molecular Weight1
422.20
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Physical Properties

Property Value Unit Source
ΔfH°gas -2916.37 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 38.01 kJ/mol Joback Calculated Property
ΔvapH° 75.17 kJ/mol Relay (1.0) Calculated Property
IE 11.20 eV Relay (1.0) Calculated Property
log10WS -4.75 Relay (1.0) Calculated Property
logPoct/wat 2.699 Crippen Calculated Property
McVol 218.190 ml/mol McGowan Calculated Property
Inp 1098.00 NIST
Tboil 480.03 K Relay (1.0) Calculated Property
Tfus 329.96 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [632.03; 689.43] J/mol×K [629.33; 784.73] Show Hide
Cp,gas 632.03 J/mol×K 629.33 Joback Calculated Property
Cp,gas 643.49 J/mol×K 655.23 Joback Calculated Property
Cp,gas 654.14 J/mol×K 681.13 Joback Calculated Property
Cp,gas 664.04 J/mol×K 707.03 Joback Calculated Property
Cp,gas 673.19 J/mol×K 732.93 Joback Calculated Property
Cp,gas 681.65 J/mol×K 758.83 Joback Calculated Property
Cp,gas 689.43 J/mol×K 784.73 Joback Calculated Property

Similar Compounds

1,1,1-Tris(hydroxymethyl)propane, tri(pentafluoropropionate). Trimethylolpropane triacrylate. di- TMPTA (Di -Trimethylol propane tetraacrylate). 1,1,1-Tris(hydroxymethyl)propane, tri(heptafluorobutyrate). di-Trimethylolpropane, tetraacrylate. EO-TMPTA (Acrylic acid 2-(2-acryloyloxy-ethoxymethyl)-2-acryloyloxymethyl-butyl ester). di-ethoxylated trimethylol propane triacrylate (Acrylic acid 2,2-bis-(2-acryloyloxy-ethoxymethyl)-butyl ester). tri-ethoxylated trimethylol propane triacrylate (Acrylic acid 2-{2-[2-(2-acryloyloxy-ethoxy)-ethoxy]-ethoxymethyl}-2-acryloyloxymethyl-butyl ester). di-ethoxylated trimethylol propane triacrylate (Acrylic acid 2-[2-(2-acryloyloxy-ethoxy)-ethoxymethyl]-2-acryloyloxymethyl-butyl ester). 2-Ethyl-1-butanol, trifluoroacetate. Meprobamate. Succinic acid, di((5-ethyl-1,3-dioxan-5-yl)methyl) ester. Succinic acid, ethyl (5-ethyl-1,3-dioxan-5-yl)methyl ester. Glutaric acid, di((5-ethyl-1,3-dioxan-5-yl)methyl) ester. Glutaric acid, (5-ethyl-1,3-dioxan-5-yl)methyl ethyl ester.

Find more compounds similar to 1,1,1-Tris(hydroxymethyl)propane, tri(trifluoroacetate).

Sources

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