Chemical Properties of (S)-(-)-1,2,4-Butanetriol, 2,4-di(trifluoroacetate)

(S)-(-)-1,2,4-Butanetriol, 2,4-di(trifluoroacetate)

InChI
InChI=1S/C8H8F6O5/c9-7(10,11)5(16)18-2-1-4(3-15)19-6(17)8(12,13)14/h4,15H,1-3H2
InChI Key
SFPBHDIELIHYRT-UHFFFAOYSA-N
Formula
C8H8F6O5
SMILES
O=C(OCCC(CO)OC(=O)C(F)(F)F)C(F)(F)F
Molecular Weight1
298.14
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Physical Properties

Property Value Unit Source
ΔfusH° 26.27 kJ/mol Joback Calculated Property
IE 11.16 eV Relay (1.0) Calculated Property
logPoct/wat 0.948 Crippen Calculated Property
McVol 154.950 ml/mol McGowan Calculated Property
Inp [1046.00; 1046.00]   Show Hide
Inp 1046.00 NIST
Inp 1046.00 NIST
Tboil 465.08 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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 [429.12; 473.34] J/mol×K [615.92; 774.18] Show Hide
Cp,gas 429.12 J/mol×K 615.92 Joback Calculated Property
Cp,gas 437.66 J/mol×K 642.30 Joback Calculated Property
Cp,gas 445.72 J/mol×K 668.67 Joback Calculated Property
Cp,gas 453.29 J/mol×K 695.05 Joback Calculated Property
Cp,gas 460.41 J/mol×K 721.43 Joback Calculated Property
Cp,gas 467.09 J/mol×K 747.80 Joback Calculated Property
Cp,gas 473.34 J/mol×K 774.18 Joback Calculated Property

Similar Compounds

(S)-(-)-1,2,4-Butanetriol, 2,4-di(pentafluoropropionate). (S)-(-)-1,2,4-Butanetriol, 2,4-di(acetate). (S)-(-)-1,2,4-Butanetriol, 2,4-di(heptafluorobutyrate). (S)-(-)-1,2,4-Butanetriol, 2-acetate. (S)-(-)-1,2,4-Butanetriol, 4-trifluoroacetate. 1,2,4-Butanetriol, triacetate. Erythritol, tetrakis(trifluoroacetate), meso-. L-Threitol, tetrakis(trifluoroacetate). (S)-(-)-1,2,4-Butanetriol, 4-pentafluoropropionate. Adonitol, pentakis(trifluoroacetate). L-(-)-Arabitol, pentakis(trifluoroacetate). D-(+)-Arabitol, pentakis(trifluoroacetate). Xylitol, pentakis(trifluoroacetate). (S)-(-)-1,2,4-Butanetriol, 4-acetate. Dulcitol, hexakis(trifluoroacetate).

Find more compounds similar to (S)-(-)-1,2,4-Butanetriol, 2,4-di(trifluoroacetate).

Sources

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