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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)-

ethyl 4-bromoquinoline-3-carboxylate

CCOC(=O)c1cnc2c(c1Br)cccc2 Request for Quotation
Chemical Name: ethyl 4-bromoquinoline-3-carboxylate
CAS Number: 1242260-12-3
Product Number: AG000LPS(AGN-PC-086DOQ)
Synonyms:
MDL No:
Molecular Formula: C12H10BrNO2
Molecular Weight: 280.1173

Identification/Properties

Computed Properties
Molecular Weight:
280.121g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
278.989g/mol
Monoisotopic Mass:
278.989g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
259
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#:
-
Hazard Statements:
H319
Precautionary Statements:
P264-P280-P305+P351+P338-P337+P313
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 4-bromoquinoline-3-carboxylate is a versatile compound widely utilized in chemical synthesis due to its unique properties. When used in organic reactions, this compound serves as a key building block for the synthesis of various pharmaceuticals, agrochemicals, and materials. Its structure containing a bromo and ester functional groups allows for diverse chemical modifications, enabling the creation of complex molecules with specific properties. In medicinal chemistry, Ethyl 4-bromoquinoline-3-carboxylate has been applied in the development of potential drug candidates targeting a range of biological pathways. Additionally, it plays a crucial role in the design and synthesis of novel materials for applications in fields such as organic electronics and catalysis.