Chemical Properties of 1,2-Propanediol, bis(heptafluorobutyrate)

1,2-Propanediol, bis(heptafluorobutyrate)

InChI
InChI=1S/C11H6F14O4/c1-3(29-5(27)7(14,15)9(18,19)11(23,24)25)2-28-4(26)6(12,13)8(16,17)10(20,21)22/h3H,2H2,1H3
InChI Key
MCZXUJJEJUJKKZ-UHFFFAOYSA-N
Formula
C11H6F14O4
SMILES
CC(COC(=O)C(F)(F)C(F)(F)C(F)(F)F)OC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
468.14
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Physical Properties

Property Value Unit Source
ΔfH°gas -3679.16 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 28.10 kJ/mol Joback Calculated Property
ΔvapH° 73.14 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.127 Crippen Calculated Property
McVol 205.510 ml/mol McGowan Calculated Property
Inp [1049.00; 1049.00]   Show Hide
Inp 1049.00 NIST
Inp 1049.00 NIST
Tboil 437.88 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 [586.60; 646.34] J/mol×K [537.68; 674.76] Show Hide
Cp,gas 586.60 J/mol×K 537.68 Joback Calculated Property
Cp,gas 598.47 J/mol×K 560.53 Joback Calculated Property
Cp,gas 609.53 J/mol×K 583.37 Joback Calculated Property
Cp,gas 619.81 J/mol×K 606.22 Joback Calculated Property
Cp,gas 629.35 J/mol×K 629.07 Joback Calculated Property
Cp,gas 638.18 J/mol×K 651.92 Joback Calculated Property
Cp,gas 646.34 J/mol×K 674.76 Joback Calculated Property

Similar Compounds

1-Ethoxy-2-propanol, heptafluorobutyrate. 1,2-Propanediol, bis(pentafluoropropionate). 1-tert-Butoxy-2-propanol, heptafluorobutyrate. 1-Propoxypropan-2-ol, heptafluorobutyrate. 1-Ethoxy-2-propanol, pentafluoropropionate. 1-Propoxypropan-2-ol, pentafluoropropionate. 1-(tert-Butoxy)propan-2-yl 2,2,3,3,3-pentafluoropropanoate. Heptafluorobutyric acid, propyl ester. (S)-(-)-1,2,4-Butanetriol, 2,4-di(heptafluorobutyrate). 1,3-Propanediol, bis(heptafluorobutyrate). 2,2,3,3,4,4,5,5,5-Nonafluoro-pentanoic acid propyl ester. 1-Butoxypropan-2-yl 2,2,3,3,3-pentafluoropropanoate. 3-Ethoxy-1-propanol, heptafluorobutyrate. Dipropylene glycol mono-tert-butyl ether, pentafluoropropionate. Heptafluorobutyric acid, 2-methylpropyl ester.

Find more compounds similar to 1,2-Propanediol, bis(heptafluorobutyrate).

Sources

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