Chemical Properties of 3-Methylcatechol, bis(trifluoroacetate) (CAS 25854-50-6)

3-Methylcatechol, bis(trifluoroacetate)

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InChI
InChI=1S/C11H6F6O4/c1-5-3-2-4-6(20-8(18)10(12,13)14)7(5)21-9(19)11(15,16)17/h2-4H,1H3
InChI Key
DHLFFAPMPMJESG-UHFFFAOYSA-N
Formula
C11H6F6O4
SMILES
Cc1cccc(OC(=O)C(F)(F)F)c1OC(=O)C(F)(F)F
Molecular Weight1
316.15
CAS
25854-50-6
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Physical Properties

Property Value Unit Source
Δf -1496.13 kJ/mol Joback Calculated Property
Δfgas -1740.54 kJ/mol Joback Calculated Property
Δfus 26.74 kJ/mol Joback Calculated Property
Δvap 54.50 kJ/mol Joback Calculated Property
log10WS -3.90 Crippen Calculated Property
logPoct/wat 2.930 Crippen Calculated Property
McVol 167.590 ml/mol McGowan Calculated Property
Pc 2239.76 kPa Joback Calculated Property
Inp [1065.00; 1065.00]   Show Hide
Inp 1065.00 NIST
Inp 1065.00 NIST
Tboil 629.46 K Joback Calculated Property
Tc 815.20 K Joback Calculated Property
Tfus 417.89 K Joback Calculated Property
Vc 0.677 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [441.58; 492.49] J/mol×K [629.46; 815.20] Show Hide
Cp,gas 441.58 J/mol×K 629.46 Joback Calculated Property
Cp,gas 451.74 J/mol×K 660.42 Joback Calculated Property
Cp,gas 461.19 J/mol×K 691.37 Joback Calculated Property
Cp,gas 469.97 J/mol×K 722.33 Joback Calculated Property
Cp,gas 478.09 J/mol×K 753.28 Joback Calculated Property
Cp,gas 485.59 J/mol×K 784.24 Joback Calculated Property
Cp,gas 492.49 J/mol×K 815.20 Joback Calculated Property

Similar Compounds

3-Methylcatechol, diacetate. 3-Methylcatechol, bis(pentafluoropropionate). 3-Methylcatechol, bis(heptafluorobutyrate). 2,5-Dimethylphenol trifluoroacetate. 2-Hydroxy-3-methoxybenzaldehyde, trifluoroacetate. 2-Methylresorcinol, bis(trifluoroacetate). 2,3-Dimethoxytoluene. Acetic acid, trifluoro-, 3-methylphenyl ester. Acetic acid, 2-methylphenyl ester. Acetic acid, 2,3-dimethylphenyl ester. Phenol, 2,5-dimethyl-, acetate. 2-Hydroxy-3-methoxybenzaldehyde, pentafluoropropionate. Phenol, 2-methoxy-3-methyl-. 2-Hydroxy-3-methoxybenzaldehyde, acetate. 2,5-Diacetoxytoluene.

Find more compounds similar to 3-Methylcatechol, bis(trifluoroacetate).

Sources

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