Cas no 5876-16-4 (2,8,9-trimethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulen-3-ol)

2,8,9-trimethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulen-3-ol structure
5876-16-4 structure
Product Name:2,8,9-trimethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulen-3-ol
CAS No:5876-16-4
MF:C20H23NO4
MW:341.40092587471
CID:948989
PubChem ID:288121
Update Time:2025-04-19

2,8,9-trimethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulen-3-ol Chemical and Physical Properties

Names and Identifiers

    • 2,8,9-trimethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulen-3-ol
    • Dibenzo[a,e]cycloocten-5,11-imin-3-ol, 5,6,11,12-tetrahydro-2,8,9-trimethoxy-13-methyl-
    • Argemonine, O2-demethyl-
    • NSC-645314
    • O2-Demethylargemonine
    • NSC-148826
    • NSC148826
    • (-)-Norargemonine
    • Norargemonine
    • NoName_1400
    • NSC645314
    • DTXSID90902180
    • 5876-16-4
    • HMS3333K13
    • O8-Demethylargemonine
    • O2-Demetylargemonie
    • Inchi: 1S/C20H23NO4/c1-21-15-6-12-8-19(24-3)20(25-4)10-14(12)16(21)5-11-7-18(23-2)17(22)9-13(11)15/h7-10,15-16,22H,5-6H2,1-4H3
    • InChI Key: ZQCGNPNWSMJDEF-UHFFFAOYSA-N
    • SMILES: O(C)C1C(=CC2=C(C=1)C1CC3C=C(C(=CC=3C(C2)N1C)O)OC)OC

Computed Properties

  • Exact Mass: 341.162708
  • Monoisotopic Mass: 341.162708
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 3
  • Complexity: 475
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 51.2
  • XLogP3: 2.9

Experimental Properties

  • Density: 1.211
  • Boiling Point: 461°C at 760 mmHg
  • Flash Point: 232.6°C
  • Refractive Index: 1.595

2,8,9-trimethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulen-3-ol Related Literature

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