Cas no 15401-66-8 (4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)-)

4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)- structure
15401-66-8 structure
Product Name:4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)-
CAS No:15401-66-8
MF:C19H19NO4
MW:325.358465433121
CID:141210
PubChem ID:3084228
Update Time:2025-04-19

4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)- Chemical and Physical Properties

Names and Identifiers

    • 4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)-
    • Nornantenine
    • CHEBI:175147
    • 1,2-Dimethoxy-9,10-methylenedioxynoraporphine
    • 4H-Benzo(de)(1,3)benzodioxolo(5,6-g)quinoline, 5,6,6a,7-tetrahydro-1,2-dimethoxy-, (S)-
    • 15401-66-8
    • N-Nornantenine
    • (+)-Nornantenine
    • 1,2-Dimethoxy-5,6,6a,7-tetrahydro-4H,10H-benzo[de][1,3]benzodioxolo[5,6-g]quinoline
    • CHEMBL1254951
    • 18,19-dimethoxy-5,7-dioxa-13-azapentacyclo[10.7.1.0^{2,10}.0^{4,8}.0^{16,20}]icosa-1(20),2,4(8),9,16,18-hexaene
    • 18,19-dimethoxy-5,7-dioxa-13-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(20),2,4(8),9,16,18-hexaene
    • DTXSID00934896
    • SCHEMBL6689417
    • CHEMBL3827872
    • BDBM50187679
    • Inchi： 1S/C19H19NO4/c1-21-16-6-10-3-4-20-13-5-11-7-14-15(24-9-23-14)8-12(11)18(17(10)13)19(16)22-2/h6-8,13,20H,3-5,9H2,1-2H3
    • InChI Key： JWXKBCGJLCEZTJ-UHFFFAOYSA-N
    • SMILES： O(C)C1=C(C=C2CCNC3CC4C=C5C(=CC=4C1=C32)OCO5)OC

Computed Properties

  • Exact Mass: 325.13147
  • Monoisotopic Mass: 325.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 2
  • Complexity: 474
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 49?2

Experimental Properties

  • Density: 1.286
  • Boiling Point: 506.1°C at 760 mmHg
  • Flash Point: 204.9°C
  • Refractive Index: 1.618
  • PSA: 48.95

4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)- Related Literature

Related Categories

15401-66-8 (4H-Benzo[de][1,3]benzodioxolo[5,6-g]quinoline,5,6,6a,7-tetrahydro-1,2-dimethoxy-, (6aS)-) Related Products

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