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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)-

Benzoic acid, 5-bromo-2-hydroxy-4-methoxy-

COc1cc(O)c(cc1Br)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 5-bromo-2-hydroxy-4-methoxy-
CAS Number: 98437-41-3
Product Number: AG003MH8(AGN-PC-00UQG2)
Synonyms:
MDL No:
Molecular Formula: C8H7BrO4
Molecular Weight: 247.0428

Identification/Properties

Computed Properties
Molecular Weight:
247.044g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
245.953g/mol
Monoisotopic Mass:
245.953g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
197
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:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Bromo-2-hydroxy-4-methoxybenzoic acid, also known as $name$, is a versatile compound widely used in chemical synthesis. One key application of this compound is its role as a building block in the synthesis of pharmaceutical compounds and agrochemicals. Its unique molecular structure makes it a valuable intermediate in the production of various biologically active molecules.In chemical synthesis, $name$ serves as a crucial starting material for the preparation of heterocyclic compounds, which are essential in drug discovery and development. Its presence in the synthetic pathway enables the introduction of specific functional groups and modifications that are vital for enhancing the biological activity and pharmacological properties of the final products.Furthermore, the presence of the bromo, hydroxyl, and methoxy groups in the molecular structure of $name$ allows for diverse chemical transformations, including substitution reactions, coupling reactions, and cyclization reactions. This versatility makes it a valuable tool in the hands of synthetic chemists seeking to design and produce novel compounds with desired properties.Overall, the strategic use of 5-Bromo-2-hydroxy-4-methoxybenzoic acid in chemical synthesis plays a crucial role in the development of new pharmaceuticals, agrochemicals, and other biologically active compounds. Its significance lies in its ability to serve as a versatile and customizable building block for complex molecule assembly, furthering the advancement of scientific research and innovation in various fields.