Cas no 118993-15-0 (5H-Pyrido[4,3-b]indol-3-amine,N-hydroxy-1,4-dimethyl-)

5H-Pyrido[4,3-b]indol-3-amine,N-hydroxy-1,4-dimethyl- structure
118993-15-0 structure
Product Name:5H-Pyrido[4,3-b]indol-3-amine,N-hydroxy-1,4-dimethyl-
CAS No:118993-15-0
MF:C13H13N3O
MW:227.261822462082
CID:194746
PubChem ID:5487965
Update Time:2025-04-19

5H-Pyrido[4,3-b]indol-3-amine,N-hydroxy-1,4-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 5H-Pyrido[4,3-b]indol-3-amine,N-hydroxy-1,4-dimethyl-
    • N-(1,4-dimethyl-5H-pyrido[4,3-b]indol-3-yl)hydroxylamine
    • 5H-Pyrido(4,3-b)indol-3-amine, N-hydroxy-1,4-dimethyl-
    • DTXSID00152275
    • N-Hydroxy-1,4-dimethyl-5H-pyrido(4,3-b)indol-3-amine
    • 118993-15-0
    • Inchi: 1S/C13H13N3O/c1-7-12-11(8(2)14-13(7)16-17)9-5-3-4-6-10(9)15-12/h3-6,15,17H,1-2H3,(H,14,16)
    • InChI Key: AHCMDZOXJBDTIZ-UHFFFAOYSA-N
    • SMILES: ONC1=C(C)C2=C(C(C)=N1)C1C=CC=CC=1N2

Computed Properties

  • Exact Mass: 226.09816
  • Monoisotopic Mass: 227.105862
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 286
  • 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: 2.1
  • Topological Polar Surface Area: 60.9

Experimental Properties

  • Density: 1.4
  • Boiling Point: 487°Cat760mmHg
  • Flash Point: 248.4°C
  • Refractive Index: 1.82
  • PSA: 58.04

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