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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)-

3-chloro-1,2-benzoxazole

Clc1noc2c1cccc2 Request for Quotation
Chemical Name: 3-chloro-1,2-benzoxazole
CAS Number: 16263-52-8
Product Number: AG007WUJ(AGN-PC-0KKZT8)
Synonyms:
MDL No:
Molecular Formula: C7H4ClNO
Molecular Weight: 153.5658

Identification/Properties

Computed Properties
Molecular Weight:
153.565g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
152.998g/mol
Monoisotopic Mass:
152.998g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
131
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-1,2-benzisoxazole, also known as CIBO, is a versatile compound widely utilized in chemical synthesis for its unique reactivity and functional group compatibility. This heterocyclic building block is particularly valued for its ability to participate in a variety of synthetic transformations, leading to the formation of diverse molecular structures with significant functional diversity.One prominent application of 3-Chloro-1,2-benzisoxazole is as a valuable precursor in the synthesis of pharmaceutical compounds. Its presence in the molecular structure can greatly influence the biological activity and pharmacokinetic properties of the final drug product. By selectively modifying the chloro group or utilizing the benzisoxazole ring system as a scaffold, medicinal chemists can tailor the properties of the target molecule to enhance its therapeutic efficacy or improve its pharmacological profile.Furthermore, 3-Chloro-1,2-benzisoxazole finds utility in the synthesis of agrochemicals and specialty chemicals due to its reactivity towards various nucleophiles and electrophiles. The chloro substituent can serve as a handle for further derivatization, enabling the introduction of additional functional groups or altering the chemical properties of the molecule. This flexibility allows for the creation of novel active compounds with potential applications in diverse industrial sectors.In summary, the strategic incorporation of 3-Chloro-1,2-benzisoxazole into synthetic pathways offers chemists a powerful tool for accessing structurally complex molecules with tailored properties. Whether employed in drug discovery, material science, or fine chemical synthesis, this versatile building block plays a crucial role in expanding the frontiers of chemical innovation and molecular design.