2-Nitroimidazole

• Catalog Number: ACM527731-2
• Product Name: 2-Nitroimidazole
• CAS: 527-73-1
• Category: Main Products
• Synonyms: 2-Nitro-imidazo
• IUPAC Name: 2-nitro-1H-imidazole
• Molecular Weight: 113.07
• Molecular Formula: C3H3N3O2
• InChI: InChI=1S/C3H3N3O2/c7-6(8)3-4-1-2-5-3/h1-2H,(H,4,5)
• InChI Key: YZEUHQHUFTYLPH-UHFFFAOYSA-N
• Boiling Point: 287 °C (dec.)-lit.
• Melting Point: 287 °C (dec.)-lit.
• Appearance: Dark yellow powder
• Complexity: 99.2
• CompoundIs Canonicalized: Yes
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Deprecated CAS: 116421-32-0, 151223-78-8
• EC Number: 208-425-5
• Exact Mass: 113.022526347g/mol
• Formal Charge: 0
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Isotope Atom Count: 0
• LogP: 0.15 (LogP)
• Monoisotopic Mass: 113.022526347g/mol
• NSC Number: 105831
• Rotatable Bond Count: 0
• Topological Polar Surface Area: 74.5Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• UNII: K8E96XL55D
• XLogP3: 0.1

Custom Q&A

What is the molecular formula of 2-Nitroimidazole?

The molecular formula of 2-Nitroimidazole is C3H3N3O2.

What are the synonyms of 2-Nitroimidazole?

The synonyms of 2-Nitroimidazole are Azomycin, 2-NITRO-1H-IMIDAZOLE, and nitroimidazole.

What is the molecular weight of 2-Nitroimidazole?

The molecular weight of 2-Nitroimidazole is 113.08 g/mol.

What is the role of 2-Nitroimidazole?

2-Nitroimidazole has a role as an antitubercular agent.

Is 2-Nitroimidazole a natural product?

Yes, 2-Nitroimidazole is a natural product found in Pseudomonas fluorescens.

What is the IUPAC name of 2-Nitroimidazole?

The IUPAC name of 2-Nitroimidazole is 2-nitro-1H-imidazole.

What is the InChI of 2-Nitroimidazole?

The InChI of 2-Nitroimidazole is InChI=1S/C3H3N3O2/c7-6(8)3-4-1-2-5-3/h1-2H,(H,4,5).

What is the InChIKey of 2-Nitroimidazole?

The InChIKey of 2-Nitroimidazole is YZEUHQHUFTYLPH-UHFFFAOYSA-N.

What is the CAS number of 2-Nitroimidazole?

The CAS number of 2-Nitroimidazole is 527-73-1.

What is the XLogP3 value of 2-Nitroimidazole?

The XLogP3 value of 2-Nitroimidazole is 0.1.