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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

4,5-Pyrimidinediamine

Nc1ncncc1N Request for Quotation
Chemical Name: 4,5-Pyrimidinediamine
CAS Number: 13754-19-3
Product Number: AG0013JH(AGN-PC-0JLUPN)
Synonyms:
MDL No: MFCD00006113
Molecular Formula: C4H6N4
Molecular Weight: 110.1172

Identification/Properties

Properties
MP:
204-206 °C(lit.)
BP:
348.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.7380 (estimate)
Computed Properties
Molecular Weight:
110.12g/mol
XLogP3:
-0.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
110.059g/mol
Monoisotopic Mass:
110.059g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
74.4
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:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


4,5-Diaminopyrimidine, a versatile building block in chemical synthesis, plays a crucial role in various industries due to its unique properties. This compound is widely utilized in the pharmaceutical and agrochemical sectors for the development of novel drugs and crop protection agents. In chemical synthesis, 4,5-Diaminopyrimidine serves as a key intermediate for the synthesis of pyrimidine derivatives, which are essential components in numerous organic compounds. Its presence allows for the efficient construction of diverse molecular structures with specific functional groups, making it an indispensable tool for organic chemists. Furthermore, the use of 4,5-Diaminopyrimidine in chemical synthesis enables the production of advanced materials and specialty chemicals that have practical applications in various fields.