Chemical Properties of 4-(Trifluoromethyl)phenylacetonitrile (CAS 2338-75-2)

4-(Trifluoromethyl)phenylacetonitrile

PDF Excel Molecule Calculator
InChI
InChI=1S/C9H6F3N/c10-9(11,12)8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
InChI Key
QNKOCFJZJWOXDE-UHFFFAOYSA-N
Formula
C9H6F3N
SMILES
N#CCc1ccc(C(F)(F)F)cc1
Molecular Weight1
185.15
CAS
2338-75-2
Other Names
  • p-Trifluoromethylphenylacetonitrile
  • Benzeneacetonitrile, 4-(trifluoromethyl)-
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 -320.73 kJ/mol Joback Calculated Property
Δfgas -436.23 kJ/mol Joback Calculated Property
Δfus 16.05 kJ/mol Joback Calculated Property
Δvap 45.30 kJ/mol Joback Calculated Property
log10WS -3.24 Crippen Calculated Property
logPoct/wat 2.771 Crippen Calculated Property
McVol 120.600 ml/mol McGowan Calculated Property
Pc 2749.78 kPa Joback Calculated Property
Tboil 533.64 K Joback Calculated Property
Tc 742.11 K Joback Calculated Property
Tfus 299.31 K Joback Calculated Property
Vc 0.500 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [272.20; 323.45] J/mol×K [533.64; 742.11] Show Hide
Cp,gas 272.20 J/mol×K 533.64 Joback Calculated Property
Cp,gas 282.50 J/mol×K 568.38 Joback Calculated Property
Cp,gas 292.03 J/mol×K 603.13 Joback Calculated Property
Cp,gas 300.84 J/mol×K 637.87 Joback Calculated Property
Cp,gas 308.99 J/mol×K 672.62 Joback Calculated Property
Cp,gas 316.51 J/mol×K 707.36 Joback Calculated Property
Cp,gas 323.45 J/mol×K 742.11 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 384.00 ± 1.00 K 1.60 NIST

Similar Compounds

1,4-Benzenediacetonitrile. Benzeneacetonitrile, 4-methyl-. Benzeneacetonitrile, 4-cyano-. Benzeneacetonitrile, 3-(trifluoromethyl)-. Benzyl nitrile. 4-Ethylphenylacetonitrile. («alpha»,«alpha»,«alpha»-Trifluoro-p-tolyl)-acetic acid. Benzeneacetonitrile, 4-chloro-. 4-Iodophenylacetonitrile. Benzeneacetonitrile, 4-bromo-. Benzeneacetonitrile, 4-fluoro-. 3-Methylbenzyl cyanide. 1,3-Benzenediacetonitrile. 2-(Trifluoromethyl)phenyl acetonitrile. 4-Benzylphenylacetonitrile.

Find more compounds similar to 4-(Trifluoromethyl)phenylacetonitrile.

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.