Cas no 112501-43-6 (Dibenz[cd,f]indol-4(5H)-one,2-hydroxy-1,3-dimethoxy-)

Dibenz[cd,f]indol-4(5H)-one,2-hydroxy-1,3-dimethoxy- structure
112501-43-6 structure
Product Name:Dibenz[cd,f]indol-4(5H)-one,2-hydroxy-1,3-dimethoxy-
CAS No:112501-43-6
MF:C17H13NO4
MW:295.289424657822
CID:186148
PubChem ID:183523
Update Time:2025-04-19

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

Names and Identifiers

    • Dibenz[cd,f]indol-4(5H)-one,2-hydroxy-1,3-dimethoxy-
    • Aristolactam FII
    • 112501-43-6
    • aristolactam F II
    • CHEMBL226655
    • DTXSID50150084
    • Dibenz(cd,f)indol-4(5H)-one, 2-hydroxy-1,3-dimethoxy-
    • Goniopetaline
    • Goniopedaline
    • Inchi: 1S/C17H13NO4/c1-21-15-11-9-6-4-3-5-8(9)7-10-12(11)13(17(20)18-10)16(22-2)14(15)19/h3-7,19H,1-2H3,(H,18,20)
    • InChI Key: UQUSUGQKCAHMQJ-UHFFFAOYSA-N
    • SMILES: O(C)C1=C(C(=C2C(NC3C=C4C=CC=CC4=C1C=32)=O)OC)O

Computed Properties

  • Exact Mass: 295.08449
  • Monoisotopic Mass: 295.084
  • 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

  • Density: 1.419
  • Boiling Point: 498.7°C at 760 mmHg
  • Flash Point: 255.4°C
  • Refractive Index: 1.736
  • PSA: 67.79

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