Cas no 116084-93-6 (Dibenz[cd,f]indol-4(5H)-one,1-hydroxy-2,3-dimethoxy-)

Dibenz[cd,f]indol-4(5H)-one,1-hydroxy-2,3-dimethoxy- structure
116084-93-6 structure
Product Name:Dibenz[cd,f]indol-4(5H)-one,1-hydroxy-2,3-dimethoxy-
CAS No:116084-93-6
MF:C17H13NO4
MW:295.289424657822
CID:211945
PubChem ID:14039008
Update Time:2025-04-19

Dibenz[cd,f]indol-4(5H)-one,1-hydroxy-2,3-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • Dibenz[cd,f]indol-4(5H)-one,1-hydroxy-2,3-dimethoxy-
    • PiperolactamB
    • Piperolactam D
    • 10-Amino-2,3-dimethoxy-4-hydroxyphenanthrene-1-carboxylic acid lactam
    • DTXSID901229282
    • 1-Hydroxy-2,3-dimethoxydibenz[cd,f]indol-4(5H)-one, 9CI
    • 15-hydroxy-13,14-dimethoxy-10-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,4,6,8,12,14-heptaen-11-one
    • 15-hydroxy-13,14-dimethoxy-10-azatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(15),2,4,6,8,12(16),13-heptaen-11-one
    • NCGC00384743-01!
    • CHEBI:174802
    • AKOS040736251
    • 1-Hydroxy-2,3-dimethoxydibenz[cd,f]indol-4(5H)-one
    • 116084-93-6
    • Inchi: 1S/C17H13NO4/c1-21-15-13-12-10(18-17(13)20)7-8-5-3-4-6-9(8)11(12)14(19)16(15)22-2/h3-7,19H,1-2H3,(H,18,20)
    • InChI Key: PHKYZFGDNGACRM-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=C(C2=C3C=CC=CC3=CC3=C2C=1C(N3)=O)O)OC

Computed Properties

  • Exact Mass: 295.08449
  • Monoisotopic Mass: 295.08445790g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 2
  • Complexity: 456
  • 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: 2.9
  • Topological Polar Surface Area: 67.8?2

Experimental Properties

  • PSA: 67.79
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