1-(6-bromo-1H-indol-3-yl)ethanone


Chemical Name: 1-(6-bromo-1H-indol-3-yl)ethanone
CAS Number: 316181-82-5
Product Number: AG007IU2(AGN-PC-0404K3)
Synonyms:
MDL No:
Molecular Formula: C10H8BrNO
Molecular Weight: 238.0806

Identification/Properties


Computed Properties
Molecular Weight:
238.084g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
236.979g/mol
Monoisotopic Mass:
236.979g/mol
Topological Polar Surface Area:
32.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
219
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Acetyl-6-bromoindole is a key reagent widely used in chemical synthesis for its unique properties and versatile applications. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and fine chemicals. Specifically, in organic chemistry, 3-Acetyl-6-bromoindole plays a crucial role as an important intermediate in the preparation of complex molecules.In the realm of drug discovery and development, this compound is utilized for the synthesis of novel heterocyclic compounds with potential biological activities. Its structural features make it a valuable precursor for the construction of biologically active molecules, making it an essential tool in medicinal chemistry research.Furthermore, 3-Acetyl-6-bromoindole is commonly employed in the synthesis of natural products and functional materials due to its ability to participate in various chemical transformations. Its reactivity enables chemists to introduce functional groups and modify molecular structures, leading to the creation of diverse compounds with enhanced properties and applications.Overall, the significance of 3-Acetyl-6-bromoindole in chemical synthesis lies in its crucial role as a versatile intermediate for the preparation of diverse compounds with potential therapeutic, agricultural, and material science applications.