Chemical Properties of 5-Methylisophthalonitrile (CAS 39718-07-5)

5-Methylisophthalonitrile

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InChI
InChI=1S/C9H6N2/c1-7-2-8(5-10)4-9(3-7)6-11/h2-4H,1H3
InChI Key
LYSGVAGOLJKEGK-UHFFFAOYSA-N
Formula
C9H6N2
SMILES
Cc1cc(C#N)cc(C#N)c1
Molecular Weight1
142.16
CAS
39718-07-5
Sources

Physical Properties

Property Value Unit Source
Δf 384.41 kJ/mol Joback Calculated Property
Δfgas 314.26 kJ/mol Joback Calculated Property
Δfus 15.34 kJ/mol Joback Calculated Property
Δvap 60.18 kJ/mol Joback Calculated Property
logPoct/wat 1.74 Crippen Calculated Property
Pc 2982.79 kPa Joback Calculated Property
Tboil 646.12 K Joback Calculated Property
Tc 890.24 K Joback Calculated Property
Tfus 372.63 K Joback Calculated Property
Vc 0.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 256.47 J/mol×K 646.12 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CN 2
-CH3 1
=C< (ring) 3
=CH- (ring) 3

Similar Compounds

1,3-Benzenedicarbonitrile. Benzonitrile, 3,5-dimethyl-. 3-Cyanobenzyl radical. Benzonitrile, 3-methyl-. 3,4-Dimethylbenzoic acid nitrile. 2,5-Dimethylbenzonitrile. Benzonitrile, 2,3-dimethyl-. 3-Cyanobenzaldehyde. 1,2,4,5-Tetracyanobenzene. Benzene-1,2,4-tricarbonitrile. Benzonitrile. Benzonitrile, 3-(bromomethyl)-. 2,6-Dimethylbenzonitrile. 2,4-Dimethylbenzonitrile. Benzonitrile, 4-methyl-.

Find more compounds similar to 5-Methylisophthalonitrile.

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