Cas no 499771-12-9 (1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE)

1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE structure
499771-12-9 structure
Product Name:1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE
CAS No:499771-12-9
MF:C11H7Cl2NO2
MW:256.084780931473
CID:841190
Update Time:2026-04-29

1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE Chemical and Physical Properties

Names and Identifiers

    • 1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE
    • 1-[3-(2,6-Dichlorophenyl)isoxazol-5-yl]ethanone
    • AC1MCMET
    • CTK4J1886
    • HMS566J09
    • Maybridge1_008831
    • MolPort-000-146-799
    • SPB07990
    • Inchi: InChI=1S/C11H7Cl2NO2/c1-6(15)10-5-9(14-16-10)11-7(12)3-2-4-8(11)13/h2-5H,1H3
    • InChI Key: JPFRJBIHUZVDFO-UHFFFAOYSA-N
    • SMILES: CC(=O)C1=CC(=NO1)C2=C(C=CC=C2Cl)Cl

Computed Properties

  • Exact Mass: 254.98551
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2

Experimental Properties

  • Melting Point: 117 °C
  • PSA: 43.1

1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE Security Information

  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38

1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE Related Literature

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