5-Chloro-3-nitropyrazolo[1,5-a]pyrimidine


Chemical Name: 5-Chloro-3-nitropyrazolo[1,5-a]pyrimidine
CAS Number: 1363380-51-1
Product Number: AG0011NW(AGN-PC-0WABBL)
Synonyms:
MDL No:
Molecular Formula: C6H3ClN4O2
Molecular Weight: 198.5666

Identification/Properties


Computed Properties
Molecular Weight:
198.566g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
197.994g/mol
Monoisotopic Mass:
197.994g/mol
Topological Polar Surface Area:
76A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
221
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Chloro-3-nitropyrazolo[1,5-a]pyrimidine is an essential intermediate in chemical synthesis with a wide range of applications. This compound serves as a versatile building block in the pharmaceutical industry, specifically in the synthesis of biologically active compounds. Its unique structure and reactivity make it a valuable tool for medicinal chemists in designing and developing new drugs.In chemical synthesis, 5-Chloro-3-nitropyrazolo[1,5-a]pyrimidine is commonly used as a key starting material for the preparation of various heterocyclic compounds. By utilizing its functional groups and reactivity, organic chemists can introduce different substituents to modify its properties and create novel molecules with desired pharmacological activities.Furthermore, this compound plays a crucial role in the development of agrochemicals, dyes, and materials science. Its synthetic versatility and compatibility with various reaction conditions make it a valuable asset in the production of advanced materials and specialty chemicals.Overall, the application of 5-Chloro-3-nitropyrazolo[1,5-a]pyrimidine in chemical synthesis showcases its importance as a building block for creating diverse compounds with potential applications in pharmaceuticals, agrochemicals, and materials science.