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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)-

Methyl 2-Amino-4-Bromo-5-Fluorobenzoate

COC(=O)c1cc(F)c(cc1N)Br Request for Quotation
Chemical Name: Methyl 2-Amino-4-Bromo-5-Fluorobenzoate
CAS Number: 1395493-30-7
Product Number: AG001B8M(AGN-PC-0WG39I)
Synonyms:
MDL No:
Molecular Formula: C8H7BrFNO2
Molecular Weight: 248.0491

Identification/Properties

Computed Properties
Molecular Weight:
248.051g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
246.964g/mol
Monoisotopic Mass:
246.964g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
203
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


Methyl 2-amino-4-bromo-5-fluorobenzoate serves as a versatile building block in chemical synthesis due to its unique functional groups. With an amino group, bromine atom, and fluorine atom strategically positioned on the aromatic ring, this compound is valued for its reactivity and ability to participate in a variety of reactions. In organic synthesis, Methyl 2-amino-4-bromo-5-fluorobenzoate can be used as a key intermediate for the construction of complex molecules, such as pharmaceuticals, agrochemicals, and materials. Its structural features make it an essential component in the development of new compounds with diverse biological activities and properties. Additionally, its incorporation into different chemical structures allows for the modulation of chemical and physical properties, making it a crucial tool in the realm of synthetic chemistry.