Chemical Properties of Heptafluorobutyric acid, 4-benzyloxyphenyl ester

Heptafluorobutyric acid, 4-benzyloxyphenyl ester

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InChI
InChI=1S/C17H11F7O3/c18-15(19,16(20,21)17(22,23)24)14(25)27-13-8-6-12(7-9-13)26-10-11-4-2-1-3-5-11/h1-9H,10H2
InChI Key
DANFPIMUIVVMHE-UHFFFAOYSA-N
Formula
C17H11F7O3
SMILES
O=C(Oc1ccc(OCc2ccccc2)cc1)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
396.26
Sources

Physical Properties

Property Value Unit Source
Δf -1386.62 kJ/mol Joback Calculated Property
Δfgas -1708.66 kJ/mol Joback Calculated Property
Δfus 30.77 kJ/mol Joback Calculated Property
Δvap 60.61 kJ/mol Joback Calculated Property
logPoct/wat 5.00 Crippen Calculated Property
Pc 1690.72 kPa Joback Calculated Property
Tboil 730.61 K Joback Calculated Property
Tc 930.36 K Joback Calculated Property
Tfus 452.49 K Joback Calculated Property
Vc 0.91 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 660.19 J/mol×K 730.61 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 7
=CH- (ring) 9
=C< (ring) 3
-CH2- 1
>C< 3
>C=O (nonring) 1

Similar Compounds

4-Methoxyphenol, heptafluorobutyrate. Hudroquinone, TFA-HFB. Benzoic acid, 4-(heptafluorobutyryloxy)-. Methyl 4-heptafluorobutyryloxybenzoate. Pentadecafluorooctanoic acid, 4-benzyloxyphenyl ester. Benzoic acid, 3-(heptafluorobutyryloxy)-. Orcinol, bis(heptafluorobutyrate). 3-Chlorophenol, heptafluorobutyrate. Heptafluorobutyric acid, 2-naphthyl ester. Resorcinol, 5-methyl, TFA-HFB. Benzoic acid, 4-heptafluorobutyryloxy-, trimethylsilyl ester. Pentafluoropropanoic acid, 4-benzyloxyphenyl ester. 2,6-Dimethoxyphenol,heptafluorobutyrate. Heptafluorobutyric acid, 2-chlorophenyl ester. Benzoic acid, 3-heptafluorobutyryloxy-, trimethylsilyl ester.

Find more compounds similar to Heptafluorobutyric acid, 4-benzyloxyphenyl ester.

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