Chemical Properties of Benzeneacetonitrile, 4-cyano- (CAS 876-31-3)

Benzeneacetonitrile, 4-cyano-

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InChI
InChI=1S/C9H6N2/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4H,5H2
InChI Key
QILKKAFYAFEWGU-UHFFFAOYSA-N
Formula
C9H6N2
SMILES
N#CCc1ccc(C#N)cc1
Molecular Weight1
142.16
CAS
876-31-3
Other Names
  • p-Tolunitrile, «alpha»-cyano-
  • «alpha»-Cyano-p-tolunitrile
  • p-Cyanobenzylcyanide
  • 4-Cyanophenylacetonitrile
  • «alpha»,4-Dicyanotoluene
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Physical Properties

Property Value Unit Source
Δf 394.04 kJ/mol Joback Calculated Property
Δfgas 325.73 kJ/mol Joback Calculated Property
Δfus 15.73 kJ/mol Joback Calculated Property
Δvap 59.52 kJ/mol Joback Calculated Property
log10WS -2.49 Crippen Calculated Property
logPoct/wat 1.624 Crippen Calculated Property
McVol 116.670 ml/mol McGowan Calculated Property
Pc 3032.27 kPa Joback Calculated Property
Tboil 641.14 K Joback Calculated Property
Tc 884.33 K Joback Calculated Property
Tfus 360.11 K Joback Calculated Property
Vc 0.483 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [258.23; 301.12] J/mol×K [641.14; 884.33] Show Hide
Cp,gas 258.23 J/mol×K 641.14 Joback Calculated Property
Cp,gas 266.88 J/mol×K 681.67 Joback Calculated Property
Cp,gas 274.89 J/mol×K 722.20 Joback Calculated Property
Cp,gas 282.28 J/mol×K 762.74 Joback Calculated Property
Cp,gas 289.09 J/mol×K 803.27 Joback Calculated Property
Cp,gas 295.36 J/mol×K 843.80 Joback Calculated Property
Cp,gas 301.12 J/mol×K 884.33 Joback Calculated Property

Similar Compounds

1,4-Benzenediacetonitrile. Benzeneacetonitrile, 4-methyl-. Benzyl nitrile. 4-(Trifluoromethyl)phenylacetonitrile. Acetonitrile, 2-(3-cyanophenyl)-. 4-Ethylphenylacetonitrile. 4-Iodophenylacetonitrile. Benzeneacetonitrile, 4-chloro-. Benzeneacetonitrile, 4-bromo-. 4-Benzylphenylacetonitrile. 1,3-Benzenediacetonitrile. 3-Methylbenzyl cyanide. Benzeneacetonitrile, 4-fluoro-. o-Tolunitrile, «alpha»-cyano-. 2-Naphthylacetonitrile.

Find more compounds similar to Benzeneacetonitrile, 4-cyano-.

Sources

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