Chemical Properties of Pentafluoropropionic acid, hexyl ester (CAS 134639-01-3)

Pentafluoropropionic acid, hexyl ester

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InChI
InChI=1S/C9H13F5O2/c1-2-3-4-5-6-16-7(15)8(10,11)9(12,13)14/h2-6H2,1H3
InChI Key
ZNCCRAMYHTXLQS-UHFFFAOYSA-N
Formula
C9H13F5O2
SMILES
CCCCCCOC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
248.19
CAS
134639-01-3
Other Names
  • 1-Hexanol, pentafluoropropionate
  • 2,2,3,3,3-Pentafluoro-propionic acid hexyl ester
  • Hexyl 2,2,3,3,3-pentafluoropropanoate
  • Hexyl pentafluoropropanoate
  • Hexyl pentafluoropropionate
  • Propanoic acid, pentafluoro, hexyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -1177.39 kJ/mol Joback Calculated Property
Δfgas -1471.94 kJ/mol Joback Calculated Property
Δfus 22.42 kJ/mol Joback Calculated Property
Δvap 38.11 kJ/mol Joback Calculated Property
logPoct/wat 3.31 Crippen Calculated Property
Pc 2023.58 kPa Joback Calculated Property
Tboil 471.50 K Joback Calculated Property
Tc 625.16 K Joback Calculated Property
Tfus 271.14 K Joback Calculated Property
Vc 0.63 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 369.49 J/mol×K 471.5 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 5
>C=O (nonring) 1
-CH2- 5
>C< 2
-CH3 1

Similar Compounds

Pentafluoropropionic acid, pentyl ester. Heptyl pentafluoropropionate. Octadecyl pentafluoropropionate. Eicosyl pentafluoropropionate. Triacontyl pentafluoropropionate. Tetracosyl pentafluoropropionate. Pentafluoropropionic acid, undecyl ester. Heneicosyl pentafluoropropionate. Tricosyl pentafluoropropionate. Pentafluoropropionic acid, octyl ester. Tetratriacontyl pentafluoropropionate. Heptacosyl pentafluoropropionate. Pentafluoropropionic acid, heptadecyl ester. Hexatriacontyl pentafluoropropionate. Nonadecyl pentafluoropropionate.

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