Cas no 23971-01-9 (Androsta-4,6,8(14)-trien-3-one,17-hydroxy-, (17b)-(9CI))

Androsta-4,6,8(14)-trien-3-one,17-hydroxy-, (17b)-(9CI) structure
23971-01-9 structure
Product Name:Androsta-4,6,8(14)-trien-3-one,17-hydroxy-, (17b)-(9CI)
CAS No:23971-01-9
MF:C19H24O2
MW:284.392665863037
CID:257816
PubChem ID:21123170
Update Time:2025-04-19

Androsta-4,6,8(14)-trien-3-one,17-hydroxy-, (17b)-(9CI) Chemical and Physical Properties

Names and Identifiers

    • Androsta-4,6,8(14)-trien-3-one,17-hydroxy-, (17b)-(9CI)
    • 17-Hydroxy-4,6,8(14)-androstatriene-3-one
    • (9R,10R,13S,17S)-17-hydroxy-10,13-dimethyl-1,2,9,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-3-one
    • Androsta-4,6,8(14)-trien-3-one, 17-hydroxy-, (17beta)-
    • 6,8(14)-Bisdehydrotestosterone
    • 23971-01-9
    • Inchi： 1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3-4,11,16-17,21H,5-10H2,1-2H3/t16-,17-,18-,19-/m0/s1
    • InChI Key： CRZAVOPLWDEYMA-VJANTYMQSA-N
    • SMILES： O[C@H]1CCC2=C3C=CC4=CC(CC[C@]4(C)[C@H]3CC[C@@]21C)=O

Computed Properties

  • Exact Mass: 284.17772
  • Monoisotopic Mass: 284.17763
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 0
  • Complexity: 609
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 37.3
  • XLogP3: 2.3

Experimental Properties

  • Density: 1.17
  • Boiling Point: 486.3°C at 760 mmHg
  • Flash Point: 206.4°C
  • Refractive Index: 1.597
  • PSA: 37.3

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