Chemical Properties of 2-Nitrobenzoic acid nitrile (CAS 612-24-8)

2-Nitrobenzoic acid nitrile

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI Key
Molecular Weight1
Other Names
  • 2-Nitrobenzoic acid nitrile
  • 2-Nitrobenzonitrile
  • Benzonitrile, o-nitro-
  • o-Cyanonitrobenzene
  • o-Nitrobenzonitrile

Physical Properties

Property Value Unit Source
EA 1.61 ± 0.10 eV NIST
EA 1.98 ± 0.05 eV NIST
Δf 279.57 kJ/mol Joback Calculated Property
Δfgas 191.37 kJ/mol Joback Calculated Property
Δfus 20.41 kJ/mol Joback Calculated Property
Δsub 88.10 ± 1.40 kJ/mol NIST
Δvap 61.18 kJ/mol Joback Calculated Property
IE 10.52 ± 0.05 eV NIST
logPoct/wat 1.47 Crippen Calculated Property
Pc 3970.51 kPa Joback Calculated Property
Tboil 645.14 K Joback Calculated Property
Tc 909.48 K Joback Calculated Property
Tfus 416.19 K Joback Calculated Property
Vc 0.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 233.38 J/mol×K 645.14 Joback Calculated Property
ΔfusH 15.72 kJ/mol 382.7 NIST
ΔsubH 87.90 ± 1.40 kJ/mol 304.0 NIST

Molecular Descriptors

Joback and Reid Groups
-CN 1
-NO2 1
=CH- (ring) 4
=C< (ring) 2

Similar Compounds

Benzonitrile, 5-chloro-2-nitro-. 4-Chloro-2-nitrobenzonitrile. 2,6-Dinitrobenzonitrile. Benzene, 1-methyl-2-nitro-. Benzene, 1,3-dimethyl-2-nitro-. 4-Cyano-3-nitrobenzotrifluoride. Benzenamine, 3-methyl-4-nitro-. Benzene, 2,4-dimethyl-1-nitro-. Benzene, 1,4-dimethyl-2-nitro-. Benzenemethanol, 2-nitro-. Benzene, 1-ethyl-2-nitro-. Benzene, 1,2-dimethyl-3-nitro-. Benzene, 2-methyl-1,4-dinitro-. Benzene, 1-(chloromethyl)-2-nitro-. Benzene, 1,3,5-trimethyl-2-nitro-.

Find more compounds similar to 2-Nitrobenzoic acid nitrile.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.