Chemical Properties of 5-Fluoro-2-methylbenzonitrile (CAS 77532-79-7)

5-Fluoro-2-methylbenzonitrile

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InChI
InChI=1S/C8H6FN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChI Key
IBRODYNXELBTJC-UHFFFAOYSA-N
Formula
C8H6FN
SMILES
Cc1ccc(F)cc1C#N
Molecular Weight1
135.14
CAS
77532-79-7
Sources

Physical Properties

Property Value Unit Source
Δf 48.00 kJ/mol Joback Calculated Property
Δfgas -26.09 kJ/mol Joback Calculated Property
Δfus 14.32 kJ/mol Joback Calculated Property
Δvap 46.66 kJ/mol Joback Calculated Property
logPoct/wat 2.01 Crippen Calculated Property
Pc 3246.73 kPa Joback Calculated Property
Tboil 520.43 K Joback Calculated Property
Tc 742.34 K Joback Calculated Property
Tfus 296.96 K Joback Calculated Property
Vc 0.42 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 208.84 J/mol×K 520.43 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Benzonitrile, 3-fluoro-. 4-Fluoro-1,2-dimethylbenzene. 2,5-Difluorobenzonitrile. 4-Fluoro-2-(trifluoromethyl)benzonitrile. Benzonitrile, 2-methyl-. Phthalonitrile. Benzonitrile, 4-fluoro-. Tetrafluorophthalonitrile. 2,6-Dimethylbenzonitrile. 3-Fluoro-o-xylene. Benzonitrile, 2,3-dimethyl-. 2,4-Dimethylbenzonitrile. 2,5-Dimethylbenzonitrile. 2,3,4-Trifluorobenzonitrile. 5-Fluoro-m-xylene.

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