1H-Indole, 7-bromo-5-chloro-


Chemical Name: 1H-Indole, 7-bromo-5-chloro-
CAS Number: 292636-08-9
Product Number: AG002XW9(AGN-PC-04Q674)
Synonyms:
MDL No: MFCD09880061
Molecular Formula: C8H5BrClN
Molecular Weight: 230.4890

Identification/Properties


Properties
BP:
348.1°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
230.489g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
0
Exact Mass:
228.929g/mol
Monoisotopic Mass:
228.929g/mol
Topological Polar Surface Area:
15.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
153
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



7-Bromo-5-chloro-1H-indole is a versatile compound with a wide range of applications in chemical synthesis. This compound serves as a valuable building block in the development of various pharmaceuticals, agrochemicals, and advanced materials. In organic synthesis, 7-Bromo-5-chloro-1H-indole is commonly utilized for the synthesis of diverse heterocyclic compounds, which are key motifs in drug discovery and material science. The presence of both bromine and chlorine atoms in its structure allows for selective functionalization reactions, enabling the formation of complex molecular structures. Additionally, the indole scaffold of this compound imparts unique electronic and steric properties that are essential for the design of bioactive molecules with specific pharmacological profiles. When employed in chemical transformations, 7-Bromo-5-chloro-1H-indole demonstrates excellent reactivity and compatibility with a variety of synthetic methods, making it a valuable tool for the efficient construction of novel compounds with tailored properties for various applications.