CAS 5424-06-6

1,2,4-Benzotriazin-3-amine, 1-oxide

Description:

1,2,4-Benzotriazin-3-amine, 1-oxide, with the CAS number 5424-06-6, is a heterocyclic organic compound characterized by its benzotriazine structure, which includes a triazine ring fused to a benzene ring. This compound features an amine group and an oxide functional group, contributing to its reactivity and potential applications in various fields. It is typically a crystalline solid, exhibiting stability under standard conditions, but may be sensitive to light or moisture. The presence of the amine group suggests potential for hydrogen bonding, influencing its solubility and interaction with other chemical species. This compound may be utilized in organic synthesis, as a dye, or in the development of pharmaceuticals due to its unique electronic properties. Additionally, its structural features may impart specific biological activities, making it of interest in medicinal chemistry. However, detailed safety and handling information should be consulted, as with any chemical substance, to ensure proper usage and risk management.

Formula: C₇H₆N₄O

InChI: InChI=1S/C7H6N4O/c8-7-9-5-3-1-2-4-6(5)11(12)10-7/h1-4H,(H2,8,9,10)

InChI key: InChIKey=BBRWGJRKAHEZBG-UHFFFAOYSA-N

SMILES: O=N=1C2=C(N=C(N)N1)C=CC=C2

Synonyms:

• 1,2,4-Benzotriazine, 3-amino-, 1-oxide
• 1-Oxido-1,2,4-benzotriazin-1-ium-3-amine
• 3-Amino-1,2,4-benzotriazin-1-ium-1-olate
• 3-Amino-1,2,4-benzotriazine 1-oxide
• 3-amino-1,2,4-benzotriazin-1(2H)-ol
• 4-Desoxytirapazamine
• Sr 4317
• Win 64012
• 1,2,4-Benzotriazin-3-amine, 1-oxide
• 1,2,4-Benzotriazin-3-amine 1-oxide

3-Amino-1,2,4-benzotriazine-1-N-oxide

Controlled Product

CAS: 5424-06-6

Applications An intermediate in the synthesis of Tirapazamine, a bioreductive anticancer agent.
References Delahoussaye, Y., et al.: Biochem. Pharmacol., 62, 1201 (2001), Chowdhury, G., et al.: Chem. Res. Toxicol., 17, 1399 (2004), Nakashima, H., et al.: Bioorg. Med. Chem., 16, 8661 (2008),

Formula: C₇H₆N₄O

Color and Shape: Neat

Molecular weight: 162.15

Ref: TR-A593640

3-AMINO-1,2,4-BENZOTRIAZINE-1-OXIDE

CAS: 5424-06-6

Formula: C₇H₆N₄O

Purity: 97%

Molecular weight: 162.152

Ref: 10-F333842