Chemical Properties of 1H-BENZIMIDAZOLE, 2-METHYL-5-NITRO-

1H-BENZIMIDAZOLE, 2-METHYL-5-NITRO-

InChI
InChI=1S/C8H7N3O2/c1-5-9-7-3-2-6(11(12)13)4-8(7)10-5/h2-4H,1H3,(H,9,10)
InChI Key
RKRXTVLCZDPERO-UHFFFAOYSA-N
Formula
C8H7N3O2
SMILES
Cc1nc2cc([N+](=O)[O-])ccc2[nH]1
Molecular Weight1
177.16
Other Names
  • 1H-Benzimidazole, 2-methyl-5-nitro-
  • Benzimidazole, 2-methyl-5-nitro-
  • Benzimidazole, 2-methyl-5(or 6)-nitro-
  • 2-Methyl-6-nitrobenzimidazole
  • 5-Nitro-2-methylbenzimidazole
  • 2-Methyl-6-nitro-1H-benzoimidazole
  • 2-methyl-5-nitro-1H-benzimidazole
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Physical Properties

Property Value Unit Source
ΔfH°gas 117.25 kJ/mol Relay (1.0) Calculated Property
IE 8.51 eV Relay (1.0) Calculated Property
log10WS -3.03 Relay (1.0) Calculated Property
logPoct/wat 1.298 Crippen Calculated Property
McVol 122.040 ml/mol McGowan Calculated Property
Tboil 592.09 K Relay (1.0) Calculated Property
Tfus 560.74 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Benzimidazole, 5-nitro-2-(trifluoromethyl)-. 1,3-dihydro-5-nitro-2H-benzimidazol-2-one. Benzimidazole, 5,6-dinitro-2-(trifluoromethyl)-. Benzimidazole, 5-chloro-6-nitro-2-(trifluoromethyl)-. Benzimidazole, 4,6-dinitro-2-(trifluoromethyl)-. Benzimidazole, 4-chloro-6-nitro-2-(trifluoromethyl)-. Benzimidazole, 4-bromo-6-nitro-2-(trifluoromethyl)-. Benzimidazole, 6-chloro-4-nitro-2-(trifluoromethyl)-. Benzimidazole, 4,5-dichloro-6-nitro-2-(trifluoromethyl)-. 1H-Benzimidazole, 2-methyl-. Benzimidazole, 6-bromo-4-nitro-2-(trifluoromethyl)-. 1H-Benzimidazol-2-acetonitrile,.alpha.([4-nitrophenyl]methylene)-. Bendazole. Benzimidazole, 5-chloro-4-nitro-2-(trifluoromethyl)-. 5-Amino-2-benzimidazolethiol.

Find more compounds similar to 1H-BENZIMIDAZOLE, 2-METHYL-5-NITRO-.

Sources

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