Chemical Properties of 2,3,4,5,6-Pentafluorophenylacetonitrile (CAS 653-30-5)

2,3,4,5,6-Pentafluorophenylacetonitrile

PDF Excel Molecule Calculator
InChI
InChI=1S/C8H2F5N/c9-4-3(1-2-14)5(10)7(12)8(13)6(4)11/h1H2
InChI Key
YDNOJUAQBFXZCR-UHFFFAOYSA-N
Formula
C8H2F5N
SMILES
N#CCc1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
207.10
CAS
653-30-5
Other Names
  • Pentafluorophenylacetonitrile
  • Benzeneacetonitrile, 2,3,4,5,6-pentafluoro-
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 -760.13 kJ/mol Joback Calculated Property
Δfgas -844.94 kJ/mol Joback Calculated Property
Δfus 25.48 kJ/mol Joback Calculated Property
Δvap 45.38 kJ/mol Joback Calculated Property
log10WS -3.80 Crippen Calculated Property
logPoct/wat 2.448 Crippen Calculated Property
McVol 110.050 ml/mol McGowan Calculated Property
Pc 2550.76 kPa Joback Calculated Property
Tboil 532.45 K Joback Calculated Property
Tc 717.16 K Joback Calculated Property
Tfus 336.88 K Joback Calculated Property
Vc 0.491 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [239.74; 275.05] J/mol×K [532.45; 717.16] Show Hide
Cp,gas 239.74 J/mol×K 532.45 Joback Calculated Property
Cp,gas 246.31 J/mol×K 563.24 Joback Calculated Property
Cp,gas 252.61 J/mol×K 594.02 Joback Calculated Property
Cp,gas 258.63 J/mol×K 624.81 Joback Calculated Property
Cp,gas 264.38 J/mol×K 655.59 Joback Calculated Property
Cp,gas 269.85 J/mol×K 686.38 Joback Calculated Property
Cp,gas 275.05 J/mol×K 717.16 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 382.00 ± 2.00 K 2.30 NIST

Similar Compounds

2,3,4,5,6-Pentafluorophenylacetic acid. 2-(Pentafluorophenyl)acetamide. Benzene, pentafluoro-2-propenyl-. Benzene, pentafluoromethyl-. C10HF7N2. Benzene, (bromomethyl)pentafluoro-. Benzene, (chloromethyl)pentafluoro-. 3-Pentafluorophenylpropionic acid. Hydrocinnamic acid, 2,3,4,5,6-pentafluoro-. Hydrocinnamamide, 2,3,4,5,6-pentafluoro-. 2,3-Difluorophenylacetonitrile. 2,3,5,6-Tetrafluoro-p-xylene. 2,3,4,5,6-Pentafluorobenzyl alcohol. «alpha»,«alpha»,«alpha»,2,3,5,6-Heptafluoro-p-xylene. 3,5-Difluorophenylacetonitrile.

Find more compounds similar to 2,3,4,5,6-Pentafluorophenylacetonitrile.

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.