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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)-, methyl ester

COC(=O)Nc1cccc(c1)Br Request for Quotation
Chemical Name: Carbamic acid, (3-bromophenyl)-, methyl ester
CAS Number: 25216-72-2
Product Number: AG00BIQ2(AGN-PC-0L9JH5)
Synonyms:
MDL No:
Molecular Formula: C8H8BrNO2
Molecular Weight: 230.0586

Identification/Properties

Computed Properties
Molecular Weight:
230.061g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
228.974g/mol
Monoisotopic Mass:
228.974g/mol
Topological Polar Surface Area:
38.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
163
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#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl (3-bromophenyl)carbamate is a versatile compound widely used in chemical synthesis. It serves as a key building block in the production of various pharmaceuticals, agrochemicals, and materials due to its unique reactivity and properties. In chemical synthesis, this compound can be utilized as a precursor in the formation of complex molecules by participating in diverse reactions such as nucleophilic substitution, palladium-catalyzed coupling, and oxidative addition processes. Its presence enables the introduction of the 3-bromophenyl and carbamate functionalities into the target molecules, allowing for precise structural modification and functional group manipulations. This compound plays a crucial role in the design and development of novel compounds with desired biological or physical properties, making it a valuable tool in the field of organic synthesis.