Cas no 898748-08-8 (2-BROMO-7-CHLORO-4-METHYLBENZOTHIAZOLE)

2-BROMO-7-CHLORO-4-METHYLBENZOTHIAZOLE structure
898748-08-8 structure
Product Name:2-BROMO-7-CHLORO-4-METHYLBENZOTHIAZOLE
CAS No:898748-08-8
MF:C8H5BrClNS
MW:262.553998708725
CID:993907
PubChem ID:24728948
Update Time:2025-04-20

2-BROMO-7-CHLORO-4-METHYLBENZOTHIAZOLE Chemical and Physical Properties

Names and Identifiers

    • 2-BROMO-7-CHLORO-4-METHYLBENZOTHIAZOLE
    • 2-bromo-7-chloro-4-methyl-1,3-benzothiazole
    • 2-bromo-7-chloro-4-methylbenzo[d]thiazole
    • QC-5201
    • EN300-7534924
    • CS-0260495
    • DTXSID30646591
    • 898748-08-8
    • Inchi: 1S/C8H5BrClNS/c1-4-2-3-5(10)7-6(4)11-8(9)12-7/h2-3H,1H3
    • InChI Key: JHOQELSQTXEIIE-UHFFFAOYSA-N
    • SMILES: BrC1=NC2=C(C(=CC=C2C)Cl)S1

Computed Properties

  • Exact Mass: 260.90100
  • Monoisotopic Mass: 260.90146g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 180
  • 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: 4.4
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • PSA: 41.13000
  • LogP: 4.02060

2-BROMO-7-CHLORO-4-METHYLBENZOTHIAZOLE Pricemore >>

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