Cas no 2506-60-7 ((1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate)

(1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate structure
2506-60-7 structure
Product Name:(1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate
CAS No:2506-60-7
MF:C22H30O3
MW:342.471807003021
CID:1420532
PubChem ID:252815
Update Time:2025-04-20

(1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate Chemical and Physical Properties

Names and Identifiers

    • (1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate
    • AC1Q6OCW
    • AG-K-27105
    • AC1L5MTA
    • NSC75052
    • CTK4F4904
    • KST-1A3140
    • AR-1A1576
    • AC1Q6OCW; AG-K-27105; AC1L5MTA; NSC75052; CTK4F4904; KST-1A3140; AR-1A1576;
    • NSC-75052
    • 2506-60-7
    • DTXSID00291355
    • Inchi： 1S/C22H30O3/c1-12(23)25-20-7-6-16-14-5-4-13-10-19(24)15-11-18(15)22(13,3)17(14)8-9-21(16,20)2/h10,14-18,20H,4-9,11H2,1-3H3/t14-,15+,16-,17-,18-,20-,21-,22-/m0/s1
    • InChI Key： DLOPLYAHWFOTGD-BCJMKXOLSA-N
    • SMILES： O(C(C)=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC([C@@H]3C[C@@H]3[C@]12C)=O

Computed Properties

  • Exact Mass: 342.2196
  • Monoisotopic Mass: 342.219
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 2
  • Complexity: 679
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • Density: 1.16
  • Boiling Point: 455.8°C at 760 mmHg
  • Flash Point: 197.9°C
  • Refractive Index: 1.562
  • PSA: 43.37
  • LogP: 4.30590

(1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate Related Literature

2506-60-7 ((1s,3as,3br,7ar,8as,8bs,8cs,10as)-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl Acetate) Related Products

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