Chemical Properties of 4-Chlorobenzoylacetonitrile (CAS 4640-66-8)

4-Chlorobenzoylacetonitrile

PDF Excel Molecule Calculator
InChI
InChI=1S/C9H6ClNO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4H,5H2
InChI Key
JYOUFPNYTOFCSJ-UHFFFAOYSA-N
Formula
C9H6ClNO
SMILES
N#CCC(=O)c1ccc(Cl)cc1
Molecular Weight1
179.60
CAS
4640-66-8
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 120.01 kJ/mol Joback Calculated Property
Δfgas 32.53 kJ/mol Joback Calculated Property
Δfus 20.02 kJ/mol Joback Calculated Property
Δvap 60.18 kJ/mol Joback Calculated Property
log10WS -3.10 Crippen Calculated Property
logPoct/wat 2.436 Crippen Calculated Property
McVol 129.100 ml/mol McGowan Calculated Property
Pc 3210.04 kPa Joback Calculated Property
Tboil 630.36 K Joback Calculated Property
Tc 870.27 K Joback Calculated Property
Tfus 374.97 K Joback Calculated Property
Vc 0.512 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [275.38; 320.08] J/mol×K [630.36; 870.27] Show Hide
Cp,gas 275.38 J/mol×K 630.36 Joback Calculated Property
Cp,gas 284.47 J/mol×K 670.34 Joback Calculated Property
Cp,gas 292.85 J/mol×K 710.33 Joback Calculated Property
Cp,gas 300.57 J/mol×K 750.31 Joback Calculated Property
Cp,gas 307.66 J/mol×K 790.30 Joback Calculated Property
Cp,gas 314.15 J/mol×K 830.28 Joback Calculated Property
Cp,gas 320.08 J/mol×K 870.27 Joback Calculated Property

Similar Compounds

3,4-Dichlorobenzoylacetonitrile. 1-Propanone, 1-(4-chlorophenyl)-. Benzenepropanenitrile, «beta»-oxo-. 3-Chlorobenzoylacetonitrile. Ethanone, 1-(4-chlorophenyl)-. 4-Toluoylacetonitrile. 1-Butanone, 1-(4-chlorophenyl)-. (4-Aminobenzoyl)acetonitrile. 2-Chloro-1-(4-chlorophenyl)ethanone. 4-Methoxybenzoylacetonitrile. 2',4'-dichloropropiophenone. 3-Methyl-1-[4-(chloromethyl)phenyl]-1-butanone. 1-Propanone, 1-phenyl-. Ethanone, 1-(3,4-dichlorophenyl)-. 3-Trifluoromethylbenzoylacetonitrile.

Find more compounds similar to 4-Chlorobenzoylacetonitrile.

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.