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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)-

7H-Pyrrolo[2,3-d]pyrimidine, 5-bromo-2-chloro-

Clc1ncc2c(n1)[nH]cc2Br Request for Quotation
Chemical Name: 7H-Pyrrolo[2,3-d]pyrimidine, 5-bromo-2-chloro-
CAS Number: 1060816-58-1
Product Number: AG0084EM(AGN-PC-07HAYG)
Synonyms:
MDL No:
Molecular Formula: C6H3BrClN3
Molecular Weight: 232.4651

Identification/Properties

Computed Properties
Molecular Weight:
232.465g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
230.92g/mol
Monoisotopic Mass:
230.92g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
157
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


5-Bromo-2-chloro-7H-pyrrolo[2,3-d]pyrimidine is a versatile compound widely utilized in chemical synthesis, particularly in the field of medicinal and organic chemistry. This compound serves as a crucial building block in the development of various pharmaceutical agents and bioactive molecules. Its unique structure and reactivity make it a valuable tool in the creation of complex organic compounds with diverse pharmacological properties. In chemical synthesis, 5-Bromo-2-chloro-7H-pyrrolo[2,3-d]pyrimidine is frequently employed as a key intermediate in the synthesis of novel drugs, agrochemicals, and functional materials. Its ability to undergo a variety of chemical transformations allows for the rapid and efficient synthesis of structurally diverse compounds with potential therapeutic applications. In addition, the presence of both bromine and chlorine substituents on the pyrrolopyrimidine scaffold imparts specific chemical reactivity, enabling the selective modification of the molecule at different positions. This controlled reactivity is essential for the precise manipulation of molecular structures and the fine-tuning of desired chemical properties in the synthesis of complex molecules. By incorporating 5-Bromo-2-chloro-7H-pyrrolo[2,3-d]pyrimidine into synthetic routes, chemists can streamline the development of new pharmaceuticals, agrochemicals, and materials with enhanced biological activities and improved chemical properties.