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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, 3-bromo-4-hydroxy-

OC(=O)c1ccc(c(c1)Br)O Request for Quotation
Chemical Name: Benzoic acid, 3-bromo-4-hydroxy-
CAS Number: 14348-41-5
Product Number: AG0038AC(AGN-PC-0JLV1O)
Synonyms:
MDL No:
Molecular Formula: C7H5BrO3
Molecular Weight: 217.0168

Identification/Properties

Computed Properties
Molecular Weight:
217.018g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
215.942g/mol
Monoisotopic Mass:
215.942g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
160
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#:
N/A
Hazard Statements:
H302-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-Bromo-4-hydroxybenzoic acid, also known as 3-bromo-4-hydroxybenzoate or Bromohydroxybenzoic acid, is a key organic compound widely used in chemical synthesis. This compound serves as a versatile building block in the creation of various pharmaceuticals, agrochemicals, and advanced materials.One of the primary applications of 3-Bromo-4-hydroxybenzoic acid in chemical synthesis is its function as a precursor in the synthesis of biologically active molecules. By undergoing various reactions, such as esterification, amidation, or nucleophilic substitution, 3-Bromo-4-hydroxybenzoic acid can be transformed into structurally diverse compounds with pharmacological properties. These derivatives have found extensive use in drug discovery and development processes.Furthermore, 3-Bromo-4-hydroxybenzoic acid is employed in the synthesis of liquid crystals, which are essential components in display technologies such as LCDs (Liquid Crystal Displays). By introducing specific functional groups to the benzene ring of the compound, chemists can tune the physicochemical properties of the resulting liquid crystals, enabling the production of high-performance display materials.Moreover, the presence of the bromo and hydroxy groups in 3-Bromo-4-hydroxybenzoic acid makes it a valuable substrate for conducting transition metal-catalyzed cross-coupling reactions. These reactions offer a powerful tool for forming carbon-carbon or carbon-heteroatom bonds, facilitating the construction of complex molecular architectures with high efficiency and selectivity.In conclusion, the versatile nature of 3-Bromo-4-hydroxybenzoic acid makes it a crucial intermediate in organic synthesis, playing a pivotal role in the development of diverse compounds with applications across various industries.