Cas no 776276-53-0 (2(3H)-Benzothiazolone,4-methoxy-3-methyl-, hydrazone)

2(3H)-Benzothiazolone,4-methoxy-3-methyl-, hydrazone structure
776276-53-0 structure
Product Name:2(3H)-Benzothiazolone,4-methoxy-3-methyl-, hydrazone
CAS No:776276-53-0
MF:C9H11N3OS
MW:209.268140077591
CID:552793
Update Time:2024-01-30

2(3H)-Benzothiazolone,4-methoxy-3-methyl-, hydrazone Chemical and Physical Properties

Names and Identifiers

    • 2(3H)-Benzothiazolone,4-methoxy-3-methyl-, hydrazone
    • 2(3H)-Benzothiazolone,4-methoxy-3-methyl-,hydrazone(9CI)
    • 2(3H)-Benzothiazolone, 4-methoxy-3-methyl-, hydrazone
    • Inchi: 1S/C9H11N3OS/c1-12-8-6(13-2)4-3-5-7(8)14-9(12)11-10/h3-5H,10H2,1-2H3
    • InChI Key: IZNVDKWRXQPIBQ-UHFFFAOYSA-N
    • SMILES: S1C2=CC=CC(OC)=C2N(C)C1=NN

Computed Properties

  • Exact Mass: 209.062
  • Monoisotopic Mass: 209.062
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 246
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 76.2A^2
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