Chemical Properties of Benzonitrile, 3,4-dimethyl- (CAS 22884-95-3)

Benzonitrile, 3,4-dimethyl-

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InChI
InChI=1S/C9H9N/c1-7-3-4-9(6-10)5-8(7)2/h3-5H,1-2H3
InChI Key
OWISXYQFTOYGRO-UHFFFAOYSA-N
Formula
C9H9N
SMILES
Cc1ccc(C#N)cc1C
Molecular Weight1
131.17
CAS
22884-95-3
Other Names
  • 1,2-Dimethyl-4-cyanobenzene
  • 3,4-Dimethylbenzonitrile
  • 3,4-Dimethylbenzoic acid nitrile

Physical Properties

Property Value Unit Source
Δf 251.23 kJ/mol Joback Calculated Property
Δfgas 149.38 kJ/mol Joback Calculated Property
Δfus 13.83 kJ/mol Joback Calculated Property
Δvap 49.71 kJ/mol Joback Calculated Property
IE 9.16 ± 0.04 eV NIST
log10WS -2.78 Crippen Calculated Property
logPoct/wat 2.175 Crippen Calculated Property
McVol 115.290 ml/mol McGowan Calculated Property
Pc 3065.95 kPa Joback Calculated Property
Tboil 544.04 K Joback Calculated Property
Tc 773.77 K Joback Calculated Property
Tfus 338.90 ± 1.00 K NIST
Vc 0.458 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [242.78; 298.89] J/mol×K [544.04; 773.77] Show Hide
Cp,gas 242.78 J/mol×K 544.04 Joback Calculated Property
Cp,gas 253.66 J/mol×K 582.33 Joback Calculated Property
Cp,gas 263.89 J/mol×K 620.62 Joback Calculated Property
Cp,gas 273.51 J/mol×K 658.91 Joback Calculated Property
Cp,gas 282.54 J/mol×K 697.19 Joback Calculated Property
Cp,gas 290.99 J/mol×K 735.48 Joback Calculated Property
Cp,gas 298.89 J/mol×K 773.77 Joback Calculated Property

Similar Compounds

2,4-Dimethylbenzonitrile. 2,5-Dimethylbenzonitrile. Benzene, 1,2,4-trimethyl-. 2,3-Dimethylbenzonitrile. Benzonitrile, 3-methyl-. 3-Cyanobenzyl radical. Benzonitrile, 2-methyl-. Benzene, 1,2,3,4-tetramethyl-. 2,6-Dimethylbenzonitrile. Benzonitrile, 2,4,6-trimethyl-. o-Xylene. 1,2-Di(methyl-d3)benzene-d4. 2-Methylbenzyl radical. Benzene, 1,2,3,5-tetramethyl-. Benzene, 1,2,3-trimethyl-.

Find more compounds similar to Benzonitrile, 3,4-dimethyl-.

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