Chemical Properties of 3-Cyanobenzyl radical (CAS 61142-85-6)

3-Cyanobenzyl radical

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InChI
InChI=1S/C8H6N/c1-7-3-2-4-8(5-7)6-9/h2-5H,1H2
InChI Key
SCLFNIOYFAYJST-UHFFFAOYSA-N
Formula
C8H6N
SMILES
[CH2]c1cccc(C#N)c1
Molecular Weight1
116.14
CAS
61142-85-6

Physical Properties

Property Value Unit Source
Δf 304.82 kJ/mol Joback Calculated Property
Δfgas 237.30 kJ/mol Joback Calculated Property
Δfus 13.32 kJ/mol Joback Calculated Property
Δvap 46.67 kJ/mol Joback Calculated Property
IE 8.60 ± 0.10 eV NIST
log10WS -1.92 Crippen Calculated Property
logPoct/wat 1.740 Crippen Calculated Property
McVol 99.050 ml/mol McGowan Calculated Property
Pc 3668.65 kPa Joback Calculated Property
Tboil 515.48 K Joback Calculated Property
Tc 744.40 K Joback Calculated Property
Tfus 300.22 K Joback Calculated Property
Vc 0.393 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [193.45; 237.60] J/mol×K [515.48; 744.40] Show Hide
Cp,gas 193.45 J/mol×K 515.48 Joback Calculated Property
Cp,gas 202.36 J/mol×K 553.63 Joback Calculated Property
Cp,gas 210.57 J/mol×K 591.79 Joback Calculated Property
Cp,gas 218.13 J/mol×K 629.94 Joback Calculated Property
Cp,gas 225.11 J/mol×K 668.09 Joback Calculated Property
Cp,gas 231.58 J/mol×K 706.24 Joback Calculated Property
Cp,gas 237.60 J/mol×K 744.40 Joback Calculated Property

Similar Compounds

Benzonitrile, 3-methyl-. Benzonitrile, 3-(bromomethyl)-. Benzonitrile, 3,5-dimethyl-. 5-Methylisophthalonitrile. Benzonitrile, 3,4-dimethyl-. 3-Methylbenzyl radical. Benzene, 1,3-dimethyl-. 2,5-Dimethylbenzonitrile. Benzonitrile, 2-methyl-. 2,3-Dimethylbenzonitrile. 3-Cyanobenzaldehyde. 4-Cyanobenzyl radical. 2,4-Dimethylbenzonitrile. 2,6-Dimethylbenzonitrile. 1,3-Dicyanobenzene.

Find more compounds similar to 3-Cyanobenzyl radical.

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