Cas no 110704-19-3 (5-Chloro-2-(chloromethyl)-1,3-benzothiazole)

5-Chloro-2-(chloromethyl)-1,3-benzothiazole structure
110704-19-3 structure
Product Name:5-Chloro-2-(chloromethyl)-1,3-benzothiazole
CAS No:110704-19-3
MF:C8H5Cl2NS
MW:218.102998495102
CID:128915
PubChem ID:10798839
Update Time:2025-09-20

5-Chloro-2-(chloromethyl)-1,3-benzothiazole Chemical and Physical Properties

Names and Identifiers

    • 5-Chloro-2-(chloromethyl)benzo[d]thiazole
    • 5-chloro-2-(chloromethyl)-1,3-benzothiazole
    • Benzothiazole,5-chloro-2-(chloromethyl)-
    • AK116833
    • CTK8G5634
    • KB-245487
    • SureCN201922
    • 2-Chloromethyl-5-chlorobenzothiazole
    • Benzothiazole, 5-chloro-2-(chloromethyl)- (9CI)
    • 5-chloro-2-chloromethyl benzothiazole
    • 5-chloro-2-chloromethyl-benzothiazole
    • LNZBRKLHATUCPG-UHFFFAOYSA-N
    • 110704-19-3
    • AKOS009468513
    • EN300-75967
    • DTXSID40445057
    • SCHEMBL201922
    • DB-358815
    • G58890
    • 5-Chloro-2-(chloromethyl)-1,3-benzothiazole
    • MDL: MFCD11217324
    • Inchi: 1S/C8H5Cl2NS/c9-4-8-11-6-3-5(10)1-2-7(6)12-8/h1-3H,4H2
    • InChI Key: LNZBRKLHATUCPG-UHFFFAOYSA-N
    • SMILES: ClC1C=CC2=C(C=1)N=C(CCl)S2

Computed Properties

  • Exact Mass: 216.95215
  • Monoisotopic Mass: 216.9519757g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 167
  • 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: 3.4
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • PSA: 12.89
  • LogP: 3.68850

5-Chloro-2-(chloromethyl)-1,3-benzothiazole Pricemore >>

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