Chemical Properties of Methyl 4-heptafluorobutyryloxybenzoate

Methyl 4-heptafluorobutyryloxybenzoate

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InChI
InChI=1S/C12H7F7O4/c1-22-8(20)6-2-4-7(5-3-6)23-9(21)10(13,14)11(15,16)12(17,18)19/h2-5H,1H3
InChI Key
UXBHVJUVNHUREV-UHFFFAOYSA-N
Formula
C12H7F7O4
SMILES
COC(=O)c1ccc(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1
Molecular Weight1
348.17
Sources

Physical Properties

Property Value Unit Source
Δf -1670.05 kJ/mol Joback Calculated Property
Δfgas -1954.57 kJ/mol Joback Calculated Property
Δfus 25.38 kJ/mol Joback Calculated Property
Δvap 53.95 kJ/mol Joback Calculated Property
logPoct/wat 3.21 Crippen Calculated Property
Pc 2029.06 kPa Joback Calculated Property
Tboil 643.40 K Joback Calculated Property
Tc 828.09 K Joback Calculated Property
Tfus 419.65 K Joback Calculated Property
Vc 0.74 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 502.86 J/mol×K 643.4 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 7
=CH- (ring) 4
=C< (ring) 2
>C< 3
-CH3 1
>C=O (nonring) 2

Similar Compounds

Benzoic acid, 4-(heptafluorobutyryloxy)-. Benzoic acid, 4-heptafluorobutyryloxy-, trimethylsilyl ester. Benzoic acid, 3-(heptafluorobutyryloxy)-. Heptafluorobutyric acid, 4-benzyloxyphenyl ester. 4-Methoxyphenol, heptafluorobutyrate. Benzoic acid, 4-heptafluorobutyryloxy-, tert.-butyldimethylsilyl ester. Hudroquinone, TFA-HFB. Orcinol, bis(heptafluorobutyrate). Resorcinol, 5-methyl, TFA-HFB. Heptafluorobutyric acid, 2-naphthyl ester. 3-Chlorophenol, heptafluorobutyrate. Benzoic acid, 3-heptafluorobutyryloxy-, trimethylsilyl ester. Methyl 2-hydroxy-4-methoxybenzoate, heptafluorobutyrate. 4-Hydroxyphenethyl alcohol, bis(heptafluorobutyrate). 3-Hydroxybenzyl alcohol, bis(heptafluorobutyrate).

Find more compounds similar to Methyl 4-heptafluorobutyryloxybenzoate.

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