CAS 4883-67-4
:2-nitrocyclohexanone
Description:
2-Nitrocyclohexanone is an organic compound characterized by a cyclohexanone ring with a nitro group (-NO2) attached to the second carbon atom. It is a colorless to pale yellow liquid with a distinctive odor, and it is soluble in organic solvents but has limited solubility in water. The presence of the nitro group introduces polarity and can influence the compound's reactivity, making it a useful intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. 2-Nitrocyclohexanone can undergo various chemical reactions, including reduction, nitration, and substitution, due to the functional groups present. It is important to handle this compound with care, as it may pose health risks if inhaled or ingested, and appropriate safety measures should be taken during its use in laboratory or industrial settings. Additionally, its stability under different conditions should be considered when storing or using the substance.
Formula:C6H9NO3
InChI:InChI=1/C6H9NO3/c8-6-4-2-1-3-5(6)7(9)10/h5H,1-4H2
InChI key:SZNILIWUUKKNPE-UHFFFAOYSA-N
SMILES:C1CCC(=O)C(C1)N(=O)=O
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2-Nitrocyclohexanone
CAS:2-Nitrocyclohexanone (2NCH) is a clinical drug that is used in the synthesis of pharmaceuticals. It can be synthesized by dinitrogen tetroxide, hydrochloric acid and magnesium oxide. 2NCH reacts with amines to form lactams. The reaction is catalyzed by organocatalysts such as copper chromite or 5-ht2c. The kinetic of this reaction has been studied extensively and it has been found that the addition of inorganic acids, such as HCl or HNO3, may increase the rate of the reaction.
The molecular formula for 2NCH is C8H8O3N2 and its structural formula is shown below:Formula:C6H9NO3Purity:Min. 95%Molecular weight:143.14 g/mol
