Chemical Properties of Pyrocatechol, 4-tert.-butyl, TFA-HFB

Pyrocatechol, 4-tert.-butyl, TFA-HFB

InChI
InChI=1S/C16H12F10O4/c1-12(2,3)7-4-5-8(29-11(28)14(19,20)21)9(6-7)30-10(27)13(17,18)15(22,23)16(24,25)26/h4-6H,1-3H3
InChI Key
KBHIFEMJPTXRFM-UHFFFAOYSA-N
Formula
C16H12F10O4
SMILES
CC(C)(C)c1ccc(OC(=O)C(F)(F)F)c(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)c1
Molecular Weight1
458.25
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Physical Properties

Property Value Unit Source
ΔfusH° 29.76 kJ/mol Joback Calculated Property
logPoct/wat 5.190 Crippen Calculated Property
McVol 245.120 ml/mol McGowan Calculated Property
Inp [1332.00; 1332.00]   Show Hide
Inp 1332.00 NIST
Inp 1332.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [736.88; 793.35] J/mol×K [731.25; 910.94] Show Hide
Cp,gas 736.88 J/mol×K 731.25 Joback Calculated Property
Cp,gas 748.28 J/mol×K 761.20 Joback Calculated Property
Cp,gas 758.79 J/mol×K 791.15 Joback Calculated Property
Cp,gas 768.48 J/mol×K 821.10 Joback Calculated Property
Cp,gas 777.42 J/mol×K 851.04 Joback Calculated Property
Cp,gas 785.69 J/mol×K 880.99 Joback Calculated Property
Cp,gas 793.35 J/mol×K 910.94 Joback Calculated Property

Similar Compounds

4-tert-Butylcatechol, O,O'-bis(heptafluorobutyrate). Pyrocatechol, 4-tert.-butyl, TFA-PFP. 4-tert-Butylcatechol, bis(pentafluoropropionate). 4-tert-Butylcatechol, bis(trifluoroacetate). 4'-Hydroxy-3'-methoxyacetophenone, heptafluorobutyrate. 4-TERT-BUTYL-O-PHENYLENE DIACETATE. 3-Ethylphenol, O-heptafluorobutyryl-. 4'-Hydroxy-3'-methoxyacetophenone, pentafluoropropionate. Vanillin, heptafluorobutyrate. Butanoic acid, heptafluoro-, 4-[2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]-1,2-phenylene ester. Dopamine, N-acetyl-PFP. 3-Heptafluorobutyryloxy-4-methoxybenzyl alcohol, O-pentafluoropropionyl-. 3-Hydroxy-4-methoxybenzyl alcohol, di(heptafluorobutyrate). 3-Pentafluoropropionyloxy-4-methoxybenzyl alcohol, O-heptafluorobutyryl-. 4-Hydroxy-3-methoxybenzyl alcohol, bis(heptafluorobutyrate).

Find more compounds similar to Pyrocatechol, 4-tert.-butyl, TFA-HFB.

Sources

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