Chemical Properties of Heneicosyl heptafluorobutyrate

Heneicosyl heptafluorobutyrate

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InChI
InChI=1S/C25H43F7O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-34-22(33)23(26,27)24(28,29)25(30,31)32/h2-21H2,1H3
InChI Key
RFTHPDMPTLHVMV-UHFFFAOYSA-N
Formula
C25H43F7O2
SMILES
CCCCCCCCCCCCCCCCCCCCCOC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
508.60
Other Names
  • 1-Heneicosanol, heptafluorobutyrate
  • Heneicosyl 2,2,3,3,4,4,4-heptafluorobutanoate
  • Heneicosyl perfluorobutyrate
Sources

Physical Properties

Property Value Unit Source
Δf -1429.45 kJ/mol Joback Calculated Property
Δfgas -2203.15 kJ/mol Joback Calculated Property
Δfus 62.61 kJ/mol Joback Calculated Property
Δvap 70.79 kJ/mol Joback Calculated Property
logPoct/wat 9.79 Crippen Calculated Property
Pc 681.71 kPa Joback Calculated Property
Tboil 832.89 K Joback Calculated Property
Tc 1024.54 K Joback Calculated Property
Tfus 455.06 K Joback Calculated Property
Vc 1.55 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1272.39 J/mol×K 832.89 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 7
-CH2- 20
>C< 3
-CH3 1
>C=O (nonring) 1

Similar Compounds

1-Heptafluorobutyryloxydecane. Hexacosyl heptafluorobutyrate. Triacontyl heptafluorobutyrate. heptafluorobutanoic acid, heptadecyl ester. Nonadecyl heptafluorobutyrate. Dotriacontyl heptafluorobutyrate. Heptafluorobutyric acid, pentadecyl ester. Heptafluorobutyric acid, n-octadecyl ester. Tetradecyl heptafluorobutyrate. Tetratriacontyl heptafluorobutyrate. Octacosyl heptafluorobutyrate. Heptacosyl heptafluorobutyrate. Tetracosyl heptafluorobutyrate. Heptafluorobutyric acid, hexadecyl ester. Heptafluorobutyric acid, undecyl ester.

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