Cas no 7313-86-2 ((-)-Cyclazocine)

(-)-Cyclazocine structure
(-)-Cyclazocine structure
Product Name:(-)-Cyclazocine
CAS No:7313-86-2
MF:C18H25NO
MW:271.397205114365
CID:977839
PubChem ID:21779964
Update Time:2025-04-19

(-)-Cyclazocine Chemical and Physical Properties

Names and Identifiers

    • (-)-Cyclazocine
    • (-)-cis-Cyclazocine
    • (2R,11R)-3-(Cyclopropylmethyl)-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2α,6α-methano-3-benzazocine-8-ol
    • (1R,9S)-10-(cyclopropylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
    • Q27076938
    • DTXSID20617937
    • AKOS030242899
    • 7313-86-2
    • GTPL1604
    • (1R,9S)-10-(cyclopropylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.0?,?]trideca-2(7),3,5-trien-4-ol
    • (2S,6R)-3-(Cyclopropylmethyl)-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-8-ol
    • (2R,11R)-3-(Cyclopropylmethyl)-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2alpha,6alpha-methano-3-benzazocine-8-ol
    • Inchi: 1S/C18H25NO/c1-12-17-9-14-5-6-15(20)10-16(14)18(12,2)7-8-19(17)11-13-3-4-13/h5-6,10,12-13,17,20H,3-4,7-9,11H2,1-2H3/t12?,17-,18+/m0/s1
    • InChI Key: YQYVFVRQLZMJKJ-OTLVQASYSA-N
    • SMILES: OC1C=CC2=C(C=1)[C@]1(C)CCN(CC3CC3)[C@@H](C2)C1C

Computed Properties

  • Exact Mass: 271.19400
  • Monoisotopic Mass: 271.193614421g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 380
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.6
  • Topological Polar Surface Area: 23.5?2

Experimental Properties

  • Melting Point: 188-190°C
  • PSA: 23.47000
  • LogP: 3.26430

(-)-Cyclazocine Pricemore >>

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