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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)-

2H-Indol-2-one, 4-bromo-1,3-dihydro-1-methyl-

O=C1Cc2c(N1C)cccc2Br Request for Quotation
Chemical Name: 2H-Indol-2-one, 4-bromo-1,3-dihydro-1-methyl-
CAS Number: 884855-68-9
Product Number: AG00GVEE(AGN-PC-0154GJ)
Synonyms:
MDL No:
Molecular Formula: C9H8BrNO
Molecular Weight: 226.0699

Identification/Properties

Computed Properties
Molecular Weight:
226.073g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
224.979g/mol
Monoisotopic Mass:
224.979g/mol
Topological Polar Surface Area:
20.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
207
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:
Danger
UN#:
2811
Hazard Statements:
H301
Precautionary Statements:
P280-P305+P351+P338
Class:
6.1
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Bromo-1-methylindolin-2-one is a versatile building block commonly used in chemical synthesis. Due to its unique structure and reactivity, this compound serves as a valuable intermediate in the production of various organic compounds. In particular, it is frequently employed in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals.One of the key applications of 4-Bromo-1-methylindolin-2-one is in the preparation of indole-based derivatives. By utilizing this compound as a starting material, chemists can introduce different functional groups and modifications to the indole ring system, thereby generating a diverse array of structurally complex molecules. These derivatives exhibit a wide range of biological activities, making them important targets in drug discovery and development.Furthermore, 4-Bromo-1-methylindolin-2-one can also be utilized in the construction of heterocyclic frameworks. Its bromo substituent provides a handle for further derivatization, enabling the synthesis of heterocycles with potential applications in materials science and medicinal chemistry. The presence of the methyl and carbonyl groups in the molecule allows for facile manipulation of its chemical properties, facilitating the creation of novel compounds with desired properties.Overall, the strategic incorporation of 4-Bromo-1-methylindolin-2-one in chemical synthesis enables the efficient construction of complex molecular architectures and the exploration of new chemical space for the development of diverse compounds with important industrial and biological implications.