Chemical Properties of Pentafluorobenzoic acid, 3-ethylphenyl ester

Pentafluorobenzoic acid, 3-ethylphenyl ester

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InChI
InChI=1S/C15H9F5O2/c1-2-7-4-3-5-8(6-7)22-15(21)9-10(16)12(18)14(20)13(19)11(9)17/h3-6H,2H2,1H3
InChI Key
QKQHDUIRUAMJNN-UHFFFAOYSA-N
Formula
C15H9F5O2
SMILES
CCc1cccc(OC(=O)c2c(F)c(F)c(F)c(F)c2F)c1
Molecular Weight1
316.22
Other Names
  • 3-Ethylphenol, pentafluorobenzoyl ester
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Physical Properties

Property Value Unit Source
Δf -965.51 kJ/mol Joback Calculated Property
Δfgas -1174.04 kJ/mol Joback Calculated Property
Δfus 38.54 kJ/mol Joback Calculated Property
Δvap 62.58 kJ/mol Joback Calculated Property
log10WS -6.02 Crippen Calculated Property
logPoct/wat 4.164 Crippen Calculated Property
McVol 190.980 ml/mol McGowan Calculated Property
Pc 1949.23 kPa Joback Calculated Property
Inp [1669.30; 1679.00]   Show Hide
Inp 1679.00 NIST
Inp 1669.30 NIST
Inp 1670.20 NIST
Inp 1671.70 NIST
Inp 1669.30 NIST
Tboil 698.48 K Joback Calculated Property
Tc 895.55 K Joback Calculated Property
Tfus 461.88 K Joback Calculated Property
Vc 0.773 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [500.33; 559.47] J/mol×K [698.48; 895.55] Show Hide
Cp,gas 500.33 J/mol×K 698.48 Joback Calculated Property
Cp,gas 511.95 J/mol×K 731.33 Joback Calculated Property
Cp,gas 522.86 J/mol×K 764.17 Joback Calculated Property
Cp,gas 533.06 J/mol×K 797.02 Joback Calculated Property
Cp,gas 542.56 J/mol×K 829.86 Joback Calculated Property
Cp,gas 551.36 J/mol×K 862.71 Joback Calculated Property
Cp,gas 559.47 J/mol×K 895.55 Joback Calculated Property

Similar Compounds

3-n-Propylphenol, pentafluorobenzoyl ester. 3-Isopropylphenol, pentafluorobenzoyl ester. 4-Ethylphenol, pentafluorobenzoyl ester. 2-Ethylphenol, pentafluorobenzoyl ester. 2,4-Difluorobenzoic acid, 3-ethylphenyl ester. 2-Fluorobenzoic acid, 3-ethylphenyl ester. 4-n-Propylphenol, pentafluorobenzoyl ester. Benzoic acid, 3-ethylphenyl ester. 5-Isopropyl-2-methylphenyl 2,3,4,5,6-pentafluorobenzoate. 3-Methyl-4-isopropylphenol, pentafluorobenzoyl ester. 3-Methylphenol, pentafluorobenzoyl ester. 3-Chloro-2-fluorobenzoic acid, 3-ethylphenyl ester. 4-Methylbenzoic acid, 3-ethylphenyl ester. 4-Isopropylphenol, pentafluorobenzoyl ester. 3-tert-Butylphenol, pentafluorobenzoyl ester.

Find more compounds similar to Pentafluorobenzoic acid, 3-ethylphenyl ester.

Sources

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