Chemical Properties of 2,6-Dimethoxyphenol,heptafluorobutyrate

2,6-Dimethoxyphenol,heptafluorobutyrate

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InChI
InChI=1S/C12H9F7O4/c1-21-6-4-3-5-7(22-2)8(6)23-9(20)10(13,14)11(15,16)12(17,18)19/h3-5H,1-2H3
InChI Key
HOUIQBCSIBUBBK-UHFFFAOYSA-N
Formula
C12H9F7O4
SMILES
COc1cccc(OC)c1OC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
350.19
Sources

Physical Properties

Property Value Unit Source
Δf -1655.76 kJ/mol Joback Calculated Property
Δfgas -1985.68 kJ/mol Joback Calculated Property
Δfus 24.58 kJ/mol Joback Calculated Property
Δvap 50.28 kJ/mol Joback Calculated Property
logPoct/wat 3.44 Crippen Calculated Property
Pc 1865.94 kPa Joback Calculated Property
Tboil 616.93 K Joback Calculated Property
Tc 794.43 K Joback Calculated Property
Tfus 404.47 K Joback Calculated Property
Vc 0.75 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 510.95 J/mol×K 616.93 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

4-tert-Butylcatechol, O,O'-bis(heptafluorobutyrate). 2,6-Dimethoxyphenol, pentafluoropropionate. 4'-Hydroxy-3'-methoxyacetophenone, heptafluorobutyrate. 3-Methylcatechol, bis(heptafluorobutyrate). 4-Methoxyphenol, heptafluorobutyrate. Hudroquinone, TFA-HFB. Resorcinol, 5-methyl, TFA-HFB. Orcinol, bis(heptafluorobutyrate). Heptafluorobutyric acid, 2-naphthyl ester. 2-Methoxy-5-nitrophenol, heptafluorobutyrate. Heptafluorobutyric acid, 4-benzyloxyphenyl ester. Benzoic acid, 4-(heptafluorobutyryloxy)-. 3-Heptafluorobutyryloxy-4-methoxybenzyl alcohol, O-pentafluoropropionyl-. 4-Hydroxy-3-methoxybenzyl alcohol, bis(heptafluorobutyrate). 3-Chlorophenol, heptafluorobutyrate.

Find more compounds similar to 2,6-Dimethoxyphenol,heptafluorobutyrate.

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