Benzenamine, 2-nitro-5-(1-piperazinyl)-


Chemical Name: Benzenamine, 2-nitro-5-(1-piperazinyl)-
CAS Number: 96103-52-5
Product Number: AG003HS6(AGN-PC-0JTLYX)
Synonyms:
MDL No:
Molecular Formula: C10H14N4O2
Molecular Weight: 222.2438

Identification/Properties


Computed Properties
Molecular Weight:
222.248g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
222.112g/mol
Monoisotopic Mass:
222.112g/mol
Topological Polar Surface Area:
87.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
250
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



2-Nitro-5-(1-piperazinyl)aniline serves as a versatile building block in chemical synthesis, particularly in the pharmaceutical industry. It is commonly utilized in the development of various organic compounds and complex molecules due to its unique structure and reactivity. This compound plays a crucial role in the synthesis of pharmaceutical drugs, such as antimalarial agents and anti-cancer medications, by serving as a key intermediate in multi-step synthetic pathways. Additionally, 2-Nitro-5-(1-piperazinyl)aniline is employed in the creation of specialized chemical probes and research tools for investigating biological processes and drug-target interactions. Its ability to undergo selective functionalization and participate in diverse chemical reactions makes it an indispensable component in the toolbox of organic chemists and medicinal chemists alike.