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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)-

Benzaldehyde, 5-bromo-3-fluoro-2-hydroxy-

O=Cc1cc(Br)cc(c1O)F Request for Quotation
Chemical Name: Benzaldehyde, 5-bromo-3-fluoro-2-hydroxy-
CAS Number: 251300-28-4
Product Number: AG002QKB(AGN-PC-0KKZGF)
Synonyms:
MDL No:
Molecular Formula: C7H4BrFO2
Molecular Weight: 219.0079

Identification/Properties

Properties
MP:
112-116 °C(lit.);
BP:
226.0±35.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
219.009g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
217.938g/mol
Monoisotopic Mass:
217.938g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
153
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Bromo-3-fluoro-2-hydroxybenzaldehyde is a versatile compound that finds wide applications in chemical synthesis due to its unique properties and reactivity. This compound is commonly used as a building block in the synthesis of various organic compounds, particularly in the pharmaceutical and agrochemical industries.One of the key applications of 5-Bromo-3-fluoro-2-hydroxybenzaldehyde is as a precursor in the synthesis of heterocyclic compounds, such as benzimidazoles and benzothiazoles. These heterocycles are important structural motifs found in many biologically active molecules, making 5-Bromo-3-fluoro-2-hydroxybenzaldehyde a valuable starting material in drug discovery and development.Additionally, 5-Bromo-3-fluoro-2-hydroxybenzaldehyde can be utilized in the synthesis of various dyes, pigments, and fluorescent probes. Its hydroxy and aldehyde functional groups allow for facile derivatization and modification, enabling the tailored design of compounds with specific optical and chemical properties.Furthermore, the presence of both bromine and fluorine substituents on the aromatic ring of 5-Bromo-3-fluoro-2-hydroxybenzaldehyde imparts unique reactivity and selectivity in cross-coupling reactions, metal-catalyzed transformations, and halogenation reactions. This compound serves as a valuable tool for chemists seeking to introduce these functional groups into target molecules with precision and efficiency in their synthetic routes.