Chemical Properties of 3-Methylphenol, pentafluorobenzoyl ester

3-Methylphenol, pentafluorobenzoyl ester

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InChI
InChI=1S/C14H7F5O2/c1-6-3-2-4-7(5-6)21-14(20)8-9(15)11(17)13(19)12(18)10(8)16/h2-5H,1H3
InChI Key
NXIZSNGOLCTTOM-UHFFFAOYSA-N
Formula
C14H7F5O2
SMILES
Cc1cccc(OC(=O)c2c(F)c(F)c(F)c(F)c2F)c1
Molecular Weight1
302.20
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Physical Properties

Property Value Unit Source
Δf -973.93 kJ/mol Joback Calculated Property
Δfgas -1153.40 kJ/mol Joback Calculated Property
Δfus 35.95 kJ/mol Joback Calculated Property
Δvap 60.35 kJ/mol Joback Calculated Property
log10WS -5.69 Crippen Calculated Property
logPoct/wat 3.910 Crippen Calculated Property
McVol 176.890 ml/mol McGowan Calculated Property
Pc 2125.60 kPa Joback Calculated Property
Inp [1576.40; 1580.10]   Show Hide
Inp 1576.40 NIST
Inp 1578.20 NIST
Inp 1580.10 NIST
Inp 1576.40 NIST
Tboil 675.60 K Joback Calculated Property
Tc 874.76 K Joback Calculated Property
Tfus 450.61 K Joback Calculated Property
Vc 0.718 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [449.69; 505.88] J/mol×K [675.60; 874.76] Show Hide
Cp,gas 449.69 J/mol×K 675.60 Joback Calculated Property
Cp,gas 460.72 J/mol×K 708.79 Joback Calculated Property
Cp,gas 471.08 J/mol×K 741.99 Joback Calculated Property
Cp,gas 480.77 J/mol×K 775.18 Joback Calculated Property
Cp,gas 489.80 J/mol×K 808.37 Joback Calculated Property
Cp,gas 498.17 J/mol×K 841.57 Joback Calculated Property
Cp,gas 505.88 J/mol×K 874.76 Joback Calculated Property

Similar Compounds

3,4-Dimethylphenol, pentafluorobenzoyl ester. 4-Methylphenol, pentafluorobenzoyl ester. 2-Methylphenol, pentafluorobenzoyl ester. 2,5-Dimethylphenol, pentafluorobenzoyl ester. 3,5-Dimethylphenol, pentafluorobenzoyl ester. 2,3,4-Trifluorobenzoic acid, 3-methylphenyl ester. Pentafluorobenzoic acid, 2,3-dimethylphenyl ester. Pentafluorobenzoic acid, 3-ethylphenyl ester. 2,6-Difluorobenzoic acid, 3-methylphenyl ester. 2,5-Difluorobenzoic acid, 3-methylphenyl ester. 2,4-Dimethylphenol, pentafluorobenzoyl ester. 2,4-Difluorobenzoic acid, 3-methylphenyl ester. 2,4,5-Trifluoro-3-methoxybenzoic acid, 3-methylphenyl ester. 3,4-Difluorobenzoic acid, 3-methylphenyl ester. 2-Fluorobenzoic acid, 3-methylphenyl ester.

Find more compounds similar to 3-Methylphenol, pentafluorobenzoyl ester.

Sources

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