Metronidazole benzoate

• CAS: 13182-89-3
• Catalog Number: ACM13182893
• Category: Inhibitors
• Molecular Weight: 275.26
• Molecular Formula: C₁₃H₁₃N₃O₄
• Description: Metronidazole Benzoate, derives from a metronidazole and a benzoic acid, has a role as an antibacterial, antimicrobial, antiparasitic, and antitrichomonal agent.
• Synonyms: 2-Methyl-5-nitro-1H-imidazole-1-ethyl benzoate; 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl benzoate; Metronidazole benzoate; Benzoylmetronildazole
• IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethylbenzoate
• Canonical SMILES: CC1=NC=C(N1CCOC(=O)C2=CC=CC=C2)[N+](=O)[O-]
• InChI Key: CUUCCLJJOWSASK-UHFFFAOYSA-N
• Boiling Point: 579.4ºC at 760 mmHg
• Flash Point: 304.2ºC
• Density: 1.31 g/cm³
• Appearance: off-white to light yellow crystalline powder
• Storage: Powder-20°C, 3 years; 4°C, 2 years; In solvent-80°C, 6 months; -20°C, 1 month.
• EC Number: 236-131-7
• Exact Mass: 275.09100
• Shipping: Can be shipped at room temperature, where not in use may vary.

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August 08, 2023

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What is the molecular formula of Metronidazole benzoate?

The molecular formula of Metronidazole benzoate is C13H13N3O4.

What are the synonyms for Metronidazole benzoate?

Some synonyms for Metronidazole benzoate include Benzoyl metronidazole, Benzoylmetronidazole, and Klion suspension.

What is the IUPAC name of Metronidazole benzoate?

The IUPAC name of Metronidazole benzoate is 2-(2-methyl-5-nitroimidazol-1-yl)ethyl benzoate.

What is the InChIKey of Metronidazole benzoate?

The InChIKey of Metronidazole benzoate is CUUCCLJJOWSASK-UHFFFAOYSA-N.

What is the CAS number of Metronidazole benzoate?

The CAS number of Metronidazole benzoate is 13182-89-3.

What are the computed descriptors of Metronidazole benzoate?

The computed descriptors of Metronidazole benzoate include its IUPAC name, InChI, InChIKey, and canonical SMILES.

What is the role of Metronidazole benzoate?

Metronidazole benzoate has a role as an antibacterial drug, an antimicrobial agent, an antiparasitic agent, an antitrichomonal drug, and a prodrug.

What is the structure of Metronidazole benzoate?

The structure of Metronidazole benzoate can be visualized in 2D and 3D representations.

What is the formal condensation that forms Metronidazole benzoate?

Metronidazole benzoate is formed from the formal condensation of benzoic acid with the hydroxy group of metronidazole.

What is the Create Date and Modify Date of Metronidazole benzoate?

The Create Date of Metronidazole benzoate is 2005-07-08, and the Modify Date is 2023-08-26.