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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, 3-bromo-, ethyl ester

CCOC(=O)c1[nH]c2c(c1Br)cccc2 Request for Quotation
Chemical Name: 1H-Indole-2-carboxylic acid, 3-bromo-, ethyl ester
CAS Number: 91348-45-7
Product Number: AG00GRDW(AGN-PC-0LFZ6I)
Synonyms:
MDL No: MFCD02071793
Molecular Formula: C11H10BrNO2
Molecular Weight: 268.1066

Identification/Properties

Properties
MP:
149-151°
BP:
387.9°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
268.11g/mol
XLogP3:
3.3
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 3-bromoindole-2-carboxylate is a versatile chemical compound that finds wide application in chemical synthesis processes. This compound serves as a crucial building block in the preparation of various pharmaceuticals, agrochemicals, and other organic molecules of interest.In chemical synthesis, Ethyl 3-bromoindole-2-carboxylate can be utilized as a key intermediate in the creation of complex molecules with specific functional groups. Its unique structure and reactivity allow for strategic transformations, such as substitution reactions, cyclizations, and coupling reactions, enabling the formation of diverse chemical structures.Furthermore, Ethyl 3-bromoindole-2-carboxylate plays a significant role in the synthesis of indole-based compounds, which are prevalent in medicinal chemistry due to their diverse biological activities. By incorporating this compound into synthetic routes, chemists can access a broad range of indole derivatives with potential pharmaceutical applications.Overall, the strategic use of Ethyl 3-bromoindole-2-carboxylate in chemical synthesis enables the efficient construction of complex organic molecules with tailored properties for various industrial and research purposes.