Cas no 101420-69-3 (7-Benzothiazolamine,2-methyl-6-nitro-)

7-Benzothiazolamine,2-methyl-6-nitro- structure
101420-69-3 structure
Product Name:7-Benzothiazolamine,2-methyl-6-nitro-
CAS No:101420-69-3
MF:C8H7N3O2S
MW:209.225079774857
CID:124648
PubChem ID:13741064
Update Time:2025-04-18

7-Benzothiazolamine,2-methyl-6-nitro- Chemical and Physical Properties

Names and Identifiers

    • 7-Benzothiazolamine,2-methyl-6-nitro-
    • Benzothiazole, 7-amino-2-methyl-6-nitro- (6CI)
    • 2-methyl-6nitro-4H-chromen-4-one
    • 2-methyl-6-nitro-4H-chromen-4-one
    • 2-methyl-6-nitro-7-aminobenzothiazole
    • 2-Methyl-6-nitro-7-amino-benzthiazol
    • 2-Methyl-6-nitro-chromen-4-on
    • 2-methyl-6-nitro-chromen-4-one
    • 2-methyl-6-nitrochromone
    • 3-Methyl-6-nitrocoumarin
    • 4H-1-Benzopyran-4-one,2-methyl-6-nitro-
    • 6-nitro-2-methyl chromone
    • AC1MC6HZ
    • ACMC-20e4be
    • CTK4A1681
    • SBB058961
    • 2-Methyl-6-nitro-7-benzothiazolamine
    • 2-Methyl-6-nitro-1,3-benzothiazol-7-amine
    • DTXSID501291502
    • 101420-69-3
    • Inchi: 1S/C8H7N3O2S/c1-4-10-5-2-3-6(11(12)13)7(9)8(5)14-4/h2-3H,9H2,1H3
    • InChI Key: LIVWKSOQCZPKEU-UHFFFAOYSA-N
    • SMILES: S1C(C)=NC2C=CC(=C(C1=2)N)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 209.025898g/mol
  • Monoisotopic Mass: 209.025898g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 245
  • 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
  • Molecular Weight: 209.23g/mol
  • XLogP3: 2.5
  • Topological Polar Surface Area: 113?2
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