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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)-

8-bromo-5-chloroisoquinoline

Clc1ccc(c2c1ccnc2)Br Request for Quotation
Chemical Name: 8-bromo-5-chloroisoquinoline
CAS Number: 927801-25-0
Product Number: AG0060TI(AGN-PC-01LRB3)
Synonyms:
MDL No:
Molecular Formula: C9H5BrClN
Molecular Weight: 242.4997

Identification/Properties

Properties
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
242.5g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
240.929g/mol
Monoisotopic Mass:
240.929g/mol
Topological Polar Surface Area:
12.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
165
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:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H319-H335
Precautionary Statements:
P261-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


8-Bromo-5-chloroisoquinoline is a versatile chemical compound widely used in the field of chemical synthesis. Due to its unique structure and reactivity, this compound serves as a valuable building block in the preparation of various organic molecules and pharmaceuticals. Its presence of both bromine and chlorine atoms make it a crucial intermediate in the synthesis of complex compounds. In organic chemistry, 8-Bromo-5-chloroisoquinoline is commonly employed as a key reagent in the creation of heterocyclic compounds, such as pyridine derivatives and other nitrogen-containing structures. Additionally, its use in medicinal chemistry has been well-documented, particularly in the development of novel drug candidates with potential therapeutic applications. Its ability to participate in diverse chemical reactions makes it an indispensable tool for researchers and chemists seeking to create innovative molecules with tailored properties and functionalities.