Cas no 80945-85-3 (2,7-dichloro-4-methyl-1,3-benzothiazole)

2,7-dichloro-4-methyl-1,3-benzothiazole structure
80945-85-3 structure
Product Name:2,7-dichloro-4-methyl-1,3-benzothiazole
CAS No:80945-85-3
MF:C8H5Cl2NS
MW:218.102998495102
MDL:MFCD04971827
CID:707938
PubChem ID:2049876
Update Time:2025-04-19

2,7-dichloro-4-methyl-1,3-benzothiazole Chemical and Physical Properties

Names and Identifiers

    • Benzothiazole,2,7-dichloro-4-methyl-
    • 2,7-Dichloro-4-methyl-1,3-benzothiazole
    • 2,7-dichloro-4-methylbenzo[d]thiazole
    • 2,7-Dichloro-4-methylbenzothiazole
    • F1910-0024
    • A840009
    • SCHEMBL2035753
    • BUYSZGJSZGEBEZ-UHFFFAOYSA-N
    • AKOS005208152
    • EN300-237788
    • 80945-85-3
    • 2-chloro-4-methyl-7-chlorobenzothiazole
    • FT-0716290
    • DTXSID60365960
    • DA-02646
    • 2,7-Dichloro-4-methyl-benzothiazole
    • DB-302565
    • 2,7-dichloro-4-methyl-1,3-benzothiazole
    • MDL: MFCD04971827
    • Inchi: 1S/C8H5Cl2NS/c1-4-2-3-5(9)7-6(4)11-8(10)12-7/h2-3H,1H3
    • InChI Key: BUYSZGJSZGEBEZ-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C)C2=C1SC(=N2)Cl

Computed Properties

  • Exact Mass: 216.95200
  • Monoisotopic Mass: 216.952
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 178
  • 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: 4.3
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • PSA: 41.13000
  • LogP: 3.91150

2,7-dichloro-4-methyl-1,3-benzothiazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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D483178-10mg
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$ 50.00 2022-06-05
TRC
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Chemenu
CM543524-250mg
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Chemenu
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Enamine
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Enamine
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