Cas no 5300-92-5 (5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole)

5-(Bromomethyl)-3-(4-chlorophenyl)isoxazole is a versatile heterocyclic compound featuring both bromomethyl and chlorophenyl functional groups, making it a valuable intermediate in organic synthesis. The bromomethyl moiety offers reactivity for further functionalization, enabling applications in cross-coupling reactions, nucleophilic substitutions, or polymer modifications. The 4-chlorophenyl group contributes to steric and electronic effects, influencing the compound's reactivity and potential pharmacological properties. This compound is particularly useful in medicinal chemistry for the development of bioactive molecules, including isoxazole-based inhibitors or agrochemicals. Its well-defined structure and stability under controlled conditions ensure consistent performance in synthetic workflows. Proper handling is advised due to the reactive bromomethyl group.
5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole structure
5300-92-5 structure
Product Name:5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole
CAS No:5300-92-5
MF:C10H7BrClNO
MW:272.525680780411
MDL:MFCD06738491
CID:377555
PubChem ID:21369
Update Time:2025-05-22

5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole Chemical and Physical Properties

Names and Identifiers

    • Isoxazole,5-(bromomethyl)-3-(4-chlorophenyl)-
    • 4-Bromomethyl-3-(4-chloro-phenyl)-isoxazole
    • 5-(bromomethyl)-3-(4-chlorophenyl)-1,2-oxazole
    • 5-(BROMOMETHYL)-3-(4-CHLOROPHENYL)ISOXAZOLE
    • 5-bromomethyl-3-(4-chlorophenyl)isoxazole
    • 5-bromomethyl-3-(4-chloro-phenyl)-isoxazole
    • 5-Bromomethyl-3-(p-chlorophenyl)isoxazole
    • AC1L2I6M
    • AC1Q3IYZ
    • BRN 1212727
    • CTK4J6875
    • ISOXAZOLE, 5-BROMOMETHYL-3-(p-CHLOROPHENYL)-
    • SureCN3688842
    • YGCXXYLQISERCR-UHFFFAOYSA-N
    • FT-0749148
    • AB27225
    • 5-(Bromomethyl)-3-(4-chlorophenyl)isoxazole, AldrichCPR
    • EN300-24531
    • DTXSID20201052
    • AKOS009096509
    • MFCD06738491
    • Z198974074
    • SCHEMBL3688842
    • 5300-92-5
    • A21568
    • 5-(bromomethyl)-3-(4-chlorophenyl)-isoxazole
    • DB-071620
    • G27680
    • 5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole
    • MDL： MFCD06738491
    • Inchi： 1S/C10H7BrClNO/c11-6-9-5-10(13-14-9)7-1-3-8(12)4-2-7/h1-5H,6H2
    • InChI Key： YGCXXYLQISERCR-UHFFFAOYSA-N
    • SMILES： BrCC1=CC(C2C=CC(=CC=2)Cl)=NO1

Computed Properties

  • Exact Mass: 270.94000
  • Monoisotopic Mass: 270.93995g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 185
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • PSA: 26.03000
  • LogP: 3.88990

5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole Security Information

  • Hazardous Material transportation number：UN 2811 6.1 / PGIII
  • Hazard Category Code： 25
  • Safety Instruction： 45
  • Hazardous Material Identification： T

5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole Customs Data

  • HS CODE：2934999090
  • Customs Data：

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole Pricemore >>

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5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole Suppliers

Amadis Chemical Company Limited
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(CAS:5300-92-5)5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole
Order Number:A21568
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:01
Price ($):424.0

5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole Related Literature

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Amadis Chemical Company Limited
(CAS:5300-92-5)5-(Bromomethyl)-3-(4-Chlorophenyl)Isoxazole
A21568
Purity:99%
Quantity:1g
Price ($):424.0
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