CAS 70102-35-1

2-Nitrobenzenecarbothioamide

Description:

2-Nitrobenzenecarbothioamide, with the CAS number 70102-35-1, is an organic compound characterized by the presence of a nitro group (-NO2) and a thioamide functional group (-C(S)NH2) attached to a benzene ring. This compound typically appears as a solid and is known for its potential applications in organic synthesis and as a building block in the development of pharmaceuticals and agrochemicals. The nitro group contributes to the compound's reactivity, making it a useful intermediate in various chemical reactions, including nucleophilic substitutions and coupling reactions. Additionally, the thioamide group can participate in diverse chemical transformations, such as the formation of thioureas or involvement in coordination chemistry. The compound's properties, including solubility and stability, can vary based on the solvent and environmental conditions. Safety data should be consulted, as compounds containing nitro and thioamide functionalities may pose health risks and require appropriate handling precautions.

Formula: C₇H₆N₂O₂S

InChI: InChI=1S/C7H6N2O2S/c8-7(12)5-3-1-2-4-6(5)9(10)11/h1-4H,(H2,8,12)

InChI key: InChIKey=YERIUXACOMCCJG-UHFFFAOYSA-N

SMILES: C(N)(=S)C1=C(N(=O)=O)C=CC=C1

Synonyms:

• 2-Nitrobenzene-1-carbothioamide
• 2-Nitrobenzthioamide
• 2-Nitrothiobenzamide
• Benzenecarbothioamide, 2-Nitro-
• NSC 263814
• 2-Nitrobenzenecarbothioamide

2-Nitrobenzene-1-carbothioamide

CAS: 70102-35-1

2-Nitrobenzene-1-carbothioamide is a hydroxylamine derivative that inhibits the activity of degraders, such as nitrosoperoxycarbonic acid, which breaks down clots. It also has an inhibitory effect on the activity of clotting enzymes and sirtuin. The compound has been shown to be useful in diagnosis of cancer and other diseases. 2-Nitrobenzene-1-carbothioamide is used in conjunction with a radioactive isotope for diagnosis. It can be conjugated to diagnostic agents for use in imaging studies or it can be used as a reagent for the identification of proteins or nucleic acids. 2-Nitrobenzene-1-carbothioamide is also used as an organic solvent in diagnostic chemistry, due to its relatively low toxicity and high stability in organic solvents.

Formula: C₇H₆N₂O₂S

Purity: Min. 95%

Molecular weight: 182.2 g/mol

Ref: 3D-VCA10235