Cas no 1158735-27-3 (5-Bromomethyl-3-(3-bromophenyl)-isoxazole)

5-Bromomethyl-3-(3-bromophenyl)-isoxazole is a brominated isoxazole derivative with significant utility in organic synthesis and pharmaceutical research. Its key structural features—a bromomethyl group and a 3-bromophenyl substituent—make it a versatile intermediate for cross-coupling reactions, nucleophilic substitutions, and further functionalization. The presence of two reactive bromine sites enhances its applicability in constructing complex molecular architectures. This compound is particularly valuable in medicinal chemistry for the development of biologically active molecules, including potential enzyme inhibitors or receptor modulators. Its stability under standard handling conditions and compatibility with diverse reaction conditions further underscore its practicality in synthetic workflows.
5-Bromomethyl-3-(3-bromophenyl)-isoxazole structure
1158735-27-3 structure
Product Name:5-Bromomethyl-3-(3-bromophenyl)-isoxazole
CAS No:1158735-27-3
MF:C10H7Br2NO
MW:316.976680994034
CID:1032070
PubChem ID:64160083
Update Time:2025-06-09

5-Bromomethyl-3-(3-bromophenyl)-isoxazole Chemical and Physical Properties

Names and Identifiers

    • 5-(Bromomethyl)-3-(3-bromophenyl)isoxazole
    • 5-(Bromomethyl)-3-(3-bromophenyl)-1,2-oxazole
    • 5-Bromomethyl-3-(3-bromophenyl)isoxazole
    • 5-Bromomethyl-3-(3-bromophenyl)-isoxazole
    • DTXSID20734734
    • DB-060759
    • AKOS013478953
    • 1158735-27-3
    • A909007
    • 5-Bromomethyl-3-(3-bromo-phenyl)-isoxaZole
    • Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
    • MFCD11840260
    • MDL： MFCD11840260
    • Inchi： 1S/C10H7Br2NO/c11-6-9-5-10(13-14-9)7-2-1-3-8(12)4-7/h1-5H,6H2
    • InChI Key： OCTOWVMASYVELT-UHFFFAOYSA-N
    • SMILES： BrC1=CC=CC(=C1)C1C=C(CBr)ON=1

Computed Properties

  • Exact Mass: 316.88739g/mol
  • Monoisotopic Mass: 314.88944g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 191
  • 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

5-Bromomethyl-3-(3-bromophenyl)-isoxazole Security Information

  • Storage Condition：Sealed in dry,2-8°C

5-Bromomethyl-3-(3-bromophenyl)-isoxazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
CM191304-1g
5-(bromomethyl)-3-(3-bromophenyl)isoxazole
 1158735-27-3 95%
1g
 $631 2021-08-05
TRC
B847020-10mg
5-Bromomethyl-3-(3-bromophenyl)-isoxazole
 1158735-27-3
10mg
 $ 50.00 2022-06-06
TRC
B847020-50mg
5-Bromomethyl-3-(3-bromophenyl)-isoxazole
 1158735-27-3
50mg
 $ 160.00 2022-06-06
TRC
B847020-100mg
5-Bromomethyl-3-(3-bromophenyl)-isoxazole
 1158735-27-3
100mg
 $ 230.00 2022-06-06
Chemenu
CM191304-1g
5-(bromomethyl)-3-(3-bromophenyl)isoxazole
 1158735-27-3 95%
1g
 $552 2023-11-24
Aaron
AR000HPD-50mg
Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
 1158735-27-3 95%
50mg
 $155.00 2025-02-13
Aaron
AR000HPD-100mg
Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
 1158735-27-3 95%
100mg
 $218.00 2025-02-13
Aaron
AR000HPD-250mg
Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
 1158735-27-3 95%
250mg
 $300.00 2025-02-13
Aaron
AR000HPD-500mg
Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
 1158735-27-3 95%
500mg
 $540.00 2025-02-13
Aaron
AR000HPD-1g
Isoxazole, 5-(bromomethyl)-3-(3-bromophenyl)-
 1158735-27-3 95%
1g
 $712.00 2025-02-13

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