Cas no 65948-26-7 (2-Amino-6-chlorobenzo[d]thiazole-4-carbonitrile)

2-Amino-6-chlorobenzo[d]thiazole-4-carbonitrile structure
65948-26-7 structure
Product Name:2-Amino-6-chlorobenzo[d]thiazole-4-carbonitrile
CAS No:65948-26-7
MF:C8H4ClN3S
MW:209.655458450317
CID:962843
Update Time:2023-08-02

2-Amino-6-chlorobenzo[d]thiazole-4-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-Benzothiazolecarbonitrile,2-amino-6-chloro-(9CI)
    • 2-amino-6-chloro-1,3-benzothiazole-4-carbonitrile
    • 4-Benzothiazolecarbonitrile, 2-amino-6-chloro-
    • 4-benzothiazolecarbonitrile,2-amino-6-chloro-
    • 2-amino-6-chlorobenzo[d]thiazole-4-carbonitrile
    • 2-Amino-6-chloro-4-benzothiazolecarbonitrile
    • 2-Amino-6-chlorobenzo[d]thiazole-4-carbonitrile
    • Inchi: 1S/C8H4ClN3S/c9-5-1-4(3-10)7-6(2-5)13-8(11)12-7/h1-2H,(H2,11,12)
    • InChI Key: BMOGEXWSZXVKOJ-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C#N)C2=C(C=1)SC(N)=N2

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 251
  • XLogP3: 2.4
  • Topological Polar Surface Area: 90.9
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