CAS 22813-31-6

Methyl 2-(2-nitro-1H-imidazol-1-yl)acetate

Description:

Methyl 2-(2-nitro-1H-imidazol-1-yl)acetate, with the CAS number 22813-31-6, is an organic compound characterized by its imidazole ring and nitro substituent. This compound typically appears as a pale yellow to light brown liquid or solid, depending on its purity and form. It is soluble in organic solvents such as ethanol and dichloromethane, but has limited solubility in water due to its hydrophobic characteristics. The presence of the nitro group contributes to its reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions and reductions. Methyl 2-(2-nitro-1H-imidazol-1-yl)acetate may exhibit biological activity, which can be of interest in medicinal chemistry, particularly in the development of pharmaceuticals. Safety data indicates that it should be handled with care, as nitro compounds can be hazardous. Overall, this compound serves as a valuable intermediate in organic synthesis and may have applications in research and industry.

Formula: C₆H₇N₃O₄

InChI: InChI=1S/C6H7N3O4/c1-13-5(10)4-8-3-2-7-6(8)9(11)12/h2-3H,4H2,1H3

InChI key: InChIKey=KXEHVMQCOHOQHB-UHFFFAOYSA-N

SMILES: N(=O)(=O)C=1N(CC(OC)=O)C=CN1

Synonyms:

• 1H-Imidazole-1-acetic acid, 2-nitro-, methyl ester
• Imidazole-1-acetic acid, 2-nitro-, methyl ester
• Methyl 2-(2-nitro-1H-imidazol-1-yl)acetate
• Methyl 2-nitroimidazole-1-acetate
• NSC 302986
• Rgw 613
• methyl (2-nitro-1H-imidazol-1-yl)acetate
• Methyl 2-nitro-1H-imidazole-1-acetate

2-Nitro-1H-imidazole-1-acetic Acid Methyl Ester

CAS: 22813-31-6

Formula: C₆H₇N₃O₄

Color and Shape: Solid

Molecular weight: 185.1375

Ref: IN-DA00BECJ

Etanidazole Impurity 1

CAS: 22813-31-6

Formula: C₆H₇N₃O₄

Molecular weight: 185.14

Ref: 4Z-E-251003

2-Nitro-1H-imidazole-1-acetic Acid Methyl Ester

Controlled Product

CAS: 22813-31-6

Applications 2-Nitro-1H-imidazole-1-acetic Acid Methyl Ester is an intermediate in the synthesis Benznidazole (B197927), is a labelled analogue of Benznidazole (B197925).
References Pavlik, C., et al.: Dyes. Pigments., 89, 9 (2010); Kasai, S., et al.: Bioorg. Med. Chem., 9, 453 (2001);

Formula: C₆H₇N₃O₄

Color and Shape: Light Yellow

Molecular weight: 185.14

Ref: TR-N496235