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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)-

tert-butyl 3-bromo-7-nitroindole-1-carboxylate

[O-][N+](=O)c1cccc2c1n(cc2Br)C(=O)OC(C)(C)C Request for Quotation
Chemical Name: tert-butyl 3-bromo-7-nitroindole-1-carboxylate
CAS Number: 914349-37-4
Product Number: AG00IGOU(AGN-PC-05W62D)
Synonyms:
MDL No:
Molecular Formula: C13H13BrN2O4
Molecular Weight: 341.1573

Identification/Properties

Computed Properties
Molecular Weight:
341.161g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
340.006g/mol
Monoisotopic Mass:
340.006g/mol
Topological Polar Surface Area:
77A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
404
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-Boc-3-Bromo-7-nitroindole is a versatile building block in chemical synthesis, commonly employed for the introduction of the Boc (tert-butoxycarbonyl) protecting group into molecules. This compound serves as a valuable intermediate in the synthesis of various organic compounds and pharmaceuticals.In organic synthesis, the Boc protecting group is widely utilized to safeguard functional groups and reactive sites in molecules during chemical reactions. By selectively introducing the 1-Boc-3-Bromo-7-nitroindole into a target molecule, chemists can shield specific reactive sites, preventing undesired side reactions and enhancing the overall efficiency of the synthesis process.Additionally, the 3-bromo and 7-nitro functionalities on the indole ring of this compound offer opportunities for further modification and diversification through cross-coupling reactions and other transformation pathways. The presence of these functional groups enhances the synthetic utility of 1-Boc-3-Bromo-7-nitroindole, making it a valuable tool for the construction of complex organic molecules with diverse structures and properties.