Cas no 39835-07-9 (6-chloro-1,2-benzoxazole)

6-chloro-1,2-benzoxazole structure
6-chloro-1,2-benzoxazole structure
Product Name:6-chloro-1,2-benzoxazole
CAS No:39835-07-9
MF:C7H4ClNO
MW:153.565760612488
CID:924956
PubChem ID:20096506
Update Time:2025-04-19

6-chloro-1,2-benzoxazole Chemical and Physical Properties

Names and Identifiers

    • 6-CHLORO-1,2-BENZISOXAZOLE
    • 6-chloro-1,2-benzoxazole
    • 6-chloranyl-1,2-benzoxazole
    • 6-Chlorbenzisoxazol
    • 6-chlorobenzisoxazole
    • EN300-1460832
    • CS-0269309
    • DB-359335
    • DTXSID20602348
    • AKOS006292083
    • SCHEMBL3557935
    • 6-CHLOROBENZO[D]ISOXAZOLE
    • AB25992
    • A824758
    • 39835-07-9
    • MDL： MFCD06659633
    • Inchi： 1S/C7H4ClNO/c8-6-2-1-5-4-9-10-7(5)3-6/h1-4H
    • InChI Key： WXVYFIRLSWWDBP-UHFFFAOYSA-N
    • SMILES： ClC1C=CC2C=NOC=2C=1

Computed Properties

  • Exact Mass: 152.99800
  • Monoisotopic Mass: 152.9981414g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 131
  • 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: 2.3
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Boiling Point: 251.2±13.0°C at 760 mmHg
  • PSA: 26.03000
  • LogP: 2.48120

6-chloro-1,2-benzoxazole Security Information

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