Chemical Properties of 4-Toluoylacetonitrile (CAS 7391-28-8)

4-Toluoylacetonitrile

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InChI
InChI=1S/C10H9NO/c1-8-2-4-9(5-3-8)10(12)6-7-11/h2-5H,6H2,1H3
InChI Key
AIECDYDQPCANJK-UHFFFAOYSA-N
Formula
C10H9NO
SMILES
Cc1ccc(C(=O)CC#N)cc1
Molecular Weight1
159.18
CAS
7391-28-8
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Physical Properties

Property Value Unit Source
Δf 140.36 kJ/mol Joback Calculated Property
Δfgas 27.63 kJ/mol Joback Calculated Property
Δfus 18.41 kJ/mol Joback Calculated Property
Δvap 58.02 kJ/mol Joback Calculated Property
log10WS -2.89 Crippen Calculated Property
logPoct/wat 2.091 Crippen Calculated Property
McVol 130.950 ml/mol McGowan Calculated Property
Pc 3005.73 kPa Joback Calculated Property
Tboil 615.81 K Joback Calculated Property
Tc 847.63 K Joback Calculated Property
Tfus 356.32 K Joback Calculated Property
Vc 0.519 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [300.20; 355.11] J/mol×K [615.81; 847.63] Show Hide
Cp,gas 300.20 J/mol×K 615.81 Joback Calculated Property
Cp,gas 311.13 J/mol×K 654.45 Joback Calculated Property
Cp,gas 321.30 J/mol×K 693.08 Joback Calculated Property
Cp,gas 330.75 J/mol×K 731.72 Joback Calculated Property
Cp,gas 339.51 J/mol×K 770.36 Joback Calculated Property
Cp,gas 347.62 J/mol×K 809.00 Joback Calculated Property
Cp,gas 355.11 J/mol×K 847.63 Joback Calculated Property

Similar Compounds

4'-Methylpropiophenone. 3-Toluoylacetonitrile. Benzenepropanenitrile, «beta»-oxo-. Ethanone, 1-(4-methylphenyl)-. 4-Chlorobenzoylacetonitrile. Ethanone, 2-bromo-1-(4-methylphenyl)-. 4'-Methylbutyrophenone. 1-(3,4-Dimethylphenyl)-1-propanone. 3'-methylpropiophenone. 3-Trifluoromethylbenzoylacetonitrile. Ethanone, 1-(4-ethylphenyl)-. 1-Pentanone, 1-(4-methylphenyl)-. 1,4-Di-(p-methyl benzoyl)-butane. 3-Chlorobenzoylacetonitrile. 4-Methoxybenzoylacetonitrile.

Find more compounds similar to 4-Toluoylacetonitrile.

Sources

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