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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)-

Carbamic acid, (3-bromophenyl)-, 1,1-dimethylethyl ester

O=C(OC(C)(C)C)Nc1cccc(c1)Br Request for Quotation
Chemical Name: Carbamic acid, (3-bromophenyl)-, 1,1-dimethylethyl ester
CAS Number: 25216-74-4
Product Number: AG003SFD(AGN-PC-0KKLMY)
Synonyms:
MDL No:
Molecular Formula: C11H14BrNO2
Molecular Weight: 272.13836

Identification/Properties

Properties
MP:
86-89 °C(lit.)
BP:
279.6±23.0 °C(Predicted)
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
272.142g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
271.021g/mol
Monoisotopic Mass:
271.021g/mol
Topological Polar Surface Area:
38.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
225
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


N-(tert-Butoxycarbonyl)-3-bromoaniline is a versatile compound widely used in chemical synthesis for its unique properties and applications. This compound serves as a valuable building block in the synthesis of various organic molecules and pharmaceuticals. Due to the presence of the tert-butoxycarbonyl (Boc) protecting group, it allows for selective reactions at specific functional groups within a molecule. The 3-bromoaniline moiety enables further derivatization through palladium-catalyzed cross-coupling reactions, making it an essential intermediate in the preparation of complex organic structures. Additionally, the presence of the bromine atom offers opportunities for diverse chemical transformations, including nucleophilic substitution and transition metal-catalyzed reactions. Overall, N-(tert-Butoxycarbonyl)-3-bromoaniline plays a crucial role in the synthesis of target compounds with tailored structures and properties for a wide range of applications in the field of organic chemistry.