4,5-Pyrimidinediamine, 2-chloro-


Chemical Name: 4,5-Pyrimidinediamine, 2-chloro-
CAS Number: 14631-08-4
Product Number: AG001DWK(AGN-PC-0JLV63)
Synonyms:
MDL No:
Molecular Formula: C4H5ClN4
Molecular Weight: 144.5623

Identification/Properties


Computed Properties
Molecular Weight:
144.562g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
144.02g/mol
Monoisotopic Mass:
144.02g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
98.6
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Chloropyrimidine-4,5-diamine is a versatile building block commonly utilized in chemical synthesis for various applications. Its unique structure makes it a valuable intermediate in the production of pharmaceuticals, agrochemicals, and fine chemicals. In organic synthesis, 2-Chloropyrimidine-4,5-diamine plays a crucial role as a key starting material in the creation of complex molecules with diverse functionalities. This compound serves as a fundamental component in the synthesis of bioactive molecules through the introduction of desired functional groups and structural modifications. Its reactivity and compatibility with a wide range of reaction conditions make it a preferred choice for chemists seeking to access novel compounds with specific properties.