Chemical Properties of 6-Fluoro-3-trifluoromethylbenzoic acid, pentafluorobenzyl ester

6-Fluoro-3-trifluoromethylbenzoic acid, pentafluorobenzyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C15H5F9O2/c16-8-2-1-5(15(22,23)24)3-6(8)14(25)26-4-7-9(17)11(19)13(21)12(20)10(7)18/h1-3H,4H2
InChI Key
UBBCOIQITAJGCO-UHFFFAOYSA-N
Formula
C15H5F9O2
SMILES
O=C(OCc1c(F)c(F)c(F)c(F)c1F)c1cc(C(F)(F)F)ccc1F
Molecular Weight1
388.18
Other Names
  • 6-Fluoro-3-trifluorobenzoic acid, pentafluorobenzyl ester
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -1751.54 kJ/mol Joback Calculated Property
Δfgas -1978.70 kJ/mol Joback Calculated Property
Δfus 43.06 kJ/mol Joback Calculated Property
Δvap 58.68 kJ/mol Joback Calculated Property
log10WS -6.92 Crippen Calculated Property
logPoct/wat 4.897 Crippen Calculated Property
McVol 198.060 ml/mol McGowan Calculated Property
Pc 1678.28 kPa Joback Calculated Property
Inp [1617.00; 1617.00]   Show Hide
Inp 1617.00 NIST
Inp 1617.00 NIST
Tboil 697.31 K Joback Calculated Property
Tc 877.52 K Joback Calculated Property
Tfus 479.18 K Joback Calculated Property
Vc 0.835 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [533.92; 584.58] J/mol×K [697.31; 877.52] Show Hide
Cp,gas 533.92 J/mol×K 697.31 Joback Calculated Property
Cp,gas 543.89 J/mol×K 727.35 Joback Calculated Property
Cp,gas 553.23 J/mol×K 757.38 Joback Calculated Property
Cp,gas 561.95 J/mol×K 787.42 Joback Calculated Property
Cp,gas 570.07 J/mol×K 817.45 Joback Calculated Property
Cp,gas 577.61 J/mol×K 847.49 Joback Calculated Property
Cp,gas 584.58 J/mol×K 877.52 Joback Calculated Property

Similar Compounds

2,5-Di(trifluoromethyl)benzoic acid, pentafluorobenzyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, pentafluorobenzyl ester. Isophthalic acid, di(pentafluorobenzyl) ester. 4-Fluoro-2-trifluoromethylbenzoic acid, pentafluorobenzyl ester. 2,6-Difluoro-3-methylbenzoic acid, pentafluorobenzyl ester. Isophthalic acid, ethyl pentafluorobenzyl ester. Isophthalic acid, pentafluorobenzyl propyl ester. Benzoic acid, (2,3,4,5-tetrafluorophenyl)methyl ester. Benzoic acid, (2,3,6-trifluorophenyl)methyl ester. Isophthalic acid, decyl pentafluorobenzyl ester. Isophthalic acid, dodecyl pentafluorobenzyl ester. Isophthalic acid, pentadecyl pentafluorobenzyl ester. Isophthalic acid, heptyl pentafluorobenzyl ester. Isophthalic acid, pentafluorobenzyl undecyl ester. Isophthalic acid, nonyl pentafluorobenzyl ester.

Find more compounds similar to 6-Fluoro-3-trifluoromethylbenzoic acid, pentafluorobenzyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.