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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)-

1H-Indole-2-carboxylic acid, 6-bromo-, ethyl ester

CCOC(=O)c1cc2c([nH]1)cc(cc2)Br Request for Quotation
Chemical Name: 1H-Indole-2-carboxylic acid, 6-bromo-, ethyl ester
CAS Number: 103858-53-3
Product Number: AG00389B(AGN-PC-0LW574)
Synonyms:
MDL No: MFCD03094942
Molecular Formula: C11H10BrNO2
Molecular Weight: 268.1066

Identification/Properties

Computed Properties
Molecular Weight:
268.11g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
266.989g/mol
Monoisotopic Mass:
266.989g/mol
Topological Polar Surface Area:
42.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
247
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 6-bromoindole-2-carboxylate is a versatile compound that finds widespread application in chemical synthesis, particularly in the field of pharmaceuticals and fine chemicals. This compound serves as a key building block in the synthesis of various biologically active molecules due to its unique structure and reactivity.One of the prominent uses of Ethyl 6-bromoindole-2-carboxylate is in the synthesis of indole derivatives, which are important structural motifs found in many natural products and pharmaceutical compounds. By utilizing this compound as a starting material, chemists can access a diverse array of indole derivatives through various chemical transformations, such as nucleophilic substitution, cross-coupling reactions, and cyclization reactions.Furthermore, Ethyl 6-bromoindole-2-carboxylate can be employed in the synthesis of molecules with potential pharmacological activities, such as anti-cancer agents, anti-inflammatory drugs, and antimicrobial compounds. Its role as a precursor in the preparation of bioactive molecules highlights its significance in medicinal chemistry and drug discovery.Overall, the use of Ethyl 6-bromoindole-2-carboxylate in chemical synthesis enables chemists to access novel compounds with diverse functionalities and biological properties, making it a valuable tool in the pursuit of new drug candidates and functional materials.