Cas no 57361-80-5 (Testosterone 17-Isocaprate)

Testosterone 17-Isocaprate structure
Testosterone 17-Isocaprate structure
Product Name:Testosterone 17-Isocaprate
CAS No:57361-80-5
MF:C29H46O3
MW:442.673749446869
CID:1075500
PubChem ID:169446826
Update Time:2025-04-20

Testosterone 17-Isocaprate Chemical and Physical Properties

Names and Identifiers

    • Testosterone 17-Isocaprate
    • testosterone isocaprate
    • 57361-80-5
    • Inchi： 1S/C29H46O3/c1-20(2)9-7-5-6-8-10-27(31)32-26-14-13-24-23-12-11-21-19-22(30)15-17-28(21,3)25(23)16-18-29(24,26)4/h19-20,23-26H,5-18H2,1-4H3/t23?,24?,25?,26-,28-,29-/m0/s1
    • InChI Key： NMHQORUVKFYTQP-SSRQPSIZSA-N
    • SMILES： O(C(CCCCCCC(C)C)=O)[C@H]1CCC2C3CCC4=CC(CC[C@]4(C)C3CC[C@@]21C)=O

Computed Properties

  • Exact Mass: 442.34469533g/mol
  • Monoisotopic Mass: 442.34469533g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 9
  • Complexity: 737
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.7
  • Topological Polar Surface Area: 43.4?2

Testosterone 17-Isocaprate Related Literature

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