Chemical Properties of 4-tert-Butylcatechol, bis(trifluoroacetate)

4-tert-Butylcatechol, bis(trifluoroacetate)

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InChI
InChI=1S/C14H12F6O4/c1-12(2,3)7-4-5-8(23-10(21)13(15,16)17)9(6-7)24-11(22)14(18,19)20/h4-6H,1-3H3
InChI Key
CGEZWQNDCPALEZ-UHFFFAOYSA-N
Formula
C14H12F6O4
SMILES
CC(C)(C)c1ccc(OC(=O)C(F)(F)F)c(OC(=O)C(F)(F)F)c1
Molecular Weight1
358.23
Other Names
  • Pyrocatechol, 5-tert.-butyl, bis-TFA
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Physical Properties

Property Value Unit Source
Δf -1468.03 kJ/mol Joback Calculated Property
Δfgas -1811.21 kJ/mol Joback Calculated Property
Δfus 27.09 kJ/mol Joback Calculated Property
Δvap 59.88 kJ/mol Joback Calculated Property
log10WS -4.74 Crippen Calculated Property
logPoct/wat 3.919 Crippen Calculated Property
McVol 209.860 ml/mol McGowan Calculated Property
Pc 1762.45 kPa Joback Calculated Property
Inp [1260.00; 1260.00]   Show Hide
Inp 1260.00 NIST
Inp 1260.00 NIST
Tboil 694.87 K Joback Calculated Property
Tc 884.41 K Joback Calculated Property
Tfus 454.12 K Joback Calculated Property
Vc 0.835 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [594.84; 654.43] J/mol×K [694.87; 884.41] Show Hide
Cp,gas 594.84 J/mol×K 694.87 Joback Calculated Property
Cp,gas 606.80 J/mol×K 726.46 Joback Calculated Property
Cp,gas 617.89 J/mol×K 758.05 Joback Calculated Property
Cp,gas 628.14 J/mol×K 789.64 Joback Calculated Property
Cp,gas 637.62 J/mol×K 821.23 Joback Calculated Property
Cp,gas 646.37 J/mol×K 852.82 Joback Calculated Property
Cp,gas 654.43 J/mol×K 884.41 Joback Calculated Property

Similar Compounds

Pyrocatechol, 4-tert.-butyl, TFA-PFP. 4-tert-Butylcatechol, bis(pentafluoropropionate). 4-tert-Butyl-O-phenylene diacetate. Pyrocatechol, 4-tert.-butyl, TFA-HFB. 4-tert-Butylcatechol, O,O'-bis(heptafluorobutyrate). 4-tert-Butylcatechol, dimethyl ether. 4'-Hydroxy-3'-methoxyacetophenone, trifluoroacetate. 4'-Hydroxy-3'-methoxyacetophenone, pentafluoropropionate. Dihydro-eugenol acetate. tert-Butylhydroquinone, diacetate. 4'-Hydroxy-3'-methoxyacetophenone, heptafluorobutyrate. m-(tert-Butyl)anisole. 4-Acetoxy-3-methoxyacetophenone. p-tert.-Butylcatechol. 3,4-Di hydroxyphenylacetic acid, TFA-ME.

Find more compounds similar to 4-tert-Butylcatechol, bis(trifluoroacetate).

Sources

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