2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine


Chemical Name: 2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine
CAS Number: 934524-10-4
Product Number: AG00GU0C(AGN-PC-09TQJW)
Synonyms:
MDL No:
Molecular Formula: C13H9Cl2N3O2S
Molecular Weight: 342.2005

Identification/Properties


Properties
BP:
447.1±55.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
342.194g/mol
XLogP3:
4.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
340.979g/mol
Monoisotopic Mass:
340.979g/mol
Topological Polar Surface Area:
73.2A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
476
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



The compound 2,4-Dichloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine is a versatile building block in chemical synthesis due to its unique structure and reactivity. It is commonly used as a key intermediate in the preparation of various heterocyclic compounds, pharmaceuticals, and agrochemicals. The presence of chloro and tosyl groups on the pyrrolopyrimidine ring allows for selective functionalization through substitution or coupling reactions. In organic synthesis, this compound serves as a valuable precursor for the modification of other molecules to introduce specific functional groups or enhance desired properties. Its role extends to the development of new materials, advanced drug candidates, and molecular probes for biological studies. Through strategic manipulation of its molecular structure, 2,4-Dichloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine enables the efficient construction of complex chemical entities with diverse applications in the field of chemistry.