Cas no 384353-72-4 (2,1-Benzisoxazole, 5-chloro-3-(3-chlorophenyl)-)

2,1-Benzisoxazole, 5-chloro-3-(3-chlorophenyl)- structure
384353-72-4 structure
Product Name:2,1-Benzisoxazole, 5-chloro-3-(3-chlorophenyl)-
CAS No:384353-72-4
MF:C13H7Cl2NO
MW:264.106781244278
CID:1489689
Update Time:2024-08-24

2,1-Benzisoxazole, 5-chloro-3-(3-chlorophenyl)- Chemical and Physical Properties

Names and Identifiers

    • 2,1-Benzisoxazole, 5-chloro-3-(3-chlorophenyl)-
    • 5-chloro-3-(3-chlorophenyl)-2,1-benzoxazole
    • Inchi: 1S/C13H7Cl2NO/c14-9-3-1-2-8(6-9)13-11-7-10(15)4-5-12(11)16-17-13/h1-7H
    • InChI Key: JPNQAONEKGKUDK-UHFFFAOYSA-N
    • SMILES: N1=C2C(C=C(Cl)C=C2)=C(C2=CC=CC(Cl)=C2)O1

Computed Properties

  • Exact Mass: 262.99061

Experimental Properties

  • Density: 1.399±0.06 g/cm3(Predicted)
  • Boiling Point: 424.2±30.0 °C(Predicted)
  • PSA: 26.03
  • pka: -5.13±0.30(Predicted)
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