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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)-

1,2-Benzisoxazole, 3-chloro-5-fluoro-

Fc1ccc2c(c1)c(Cl)no2 Request for Quotation
Chemical Name: 1,2-Benzisoxazole, 3-chloro-5-fluoro-
CAS Number: 178747-50-7
Product Number: AG0026AF(AGN-PC-00PAI3)
Synonyms:
MDL No:
Molecular Formula: C7H3ClFNO
Molecular Weight: 171.5562

Identification/Properties

Computed Properties
Molecular Weight:
171.555g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
170.989g/mol
Monoisotopic Mass:
170.989g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
157
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


3-Chloro-5-fluorobenzo[d]isoxazole is a valuable compound widely utilized in chemical synthesis for its unique properties and reactivity. Due to its structural characteristics, this compound serves as a versatile building block in the creation of various pharmaceuticals, agrochemicals, and materials. In chemical synthesis, 3-Chloro-5-fluorobenzo[d]isoxazole is often employed as a precursor in the formation of complex molecules. Its strategic placement of chlorine and fluorine atoms enables selective functionalization reactions, allowing chemists to introduce specific groups at desired positions. By leveraging the reactivity of the chloro and fluoro substituents, chemists can tailor the molecular structure of the final product to impart specific properties or enhance biological activity.Furthermore, the presence of the benzo[d]isoxazole ring system confers unique aromaticity and electronic properties to compounds derived from 3-Chloro-5-fluorobenzo[d]isoxazole. This feature can lead to improved stability, increased binding affinity, or altered pharmacokinetic profiles in drug candidates developed through its incorporation.Overall, the application of 3-Chloro-5-fluorobenzo[d]isoxazole in chemical synthesis enables the efficient construction of diverse molecular scaffolds with tailored functionalities, thus playing a crucial role in the discovery and development of novel compounds across various industries.