Cas no 40335-86-2 ((s)-qinoclidinole)

(s)-qinoclidinole structure
(s)-qinoclidinole structure
Product Name:(s)-qinoclidinole
CAS No:40335-86-2
MF:C8H14O
MW:126.196162700653
CID:1512359
PubChem ID:12754137
Update Time:2025-04-21

(s)-qinoclidinole Chemical and Physical Properties

Names and Identifiers

    • (S)-Qinoclidinole
    • exo-2-Hydroxy-bicyclo&lt
    • 2.2.2&gt
    • octan
    • (S)-Homoserine-lactone hydrochloride
    • AC1MBZEX
    • (2S)-Hydroxy-bicyclo&lt
    • SureCN787339
    • Bicyclo[2.2.2]octanol-(2)
    • 2-Bicyclo&lt
    • octanol
    • L-Homoserine lactone hydrochloride
    • L-Homoserine lactone HCl
    • (2S)-homoserine lactone hydrochloride
    • (S)-(-)-3-Aminotetrahydrofuran-2-one Hydrochloride
    • Bicyclo&lt
    • octanol-(2)
    • PubChem13830
    • (S)-Bicyclo[2.2.2]octan-2-ol
    • (2S)-Hydroxy-bicyclo< 2.2.2> octan
    • (S)-(+)-
    • 2-Bicyclo< 2.2.2> octanol
    • A-amino-
    • A-butyrolactone hydrochloride
    • Bicyclo< 2.2.2> octanol-
    • exo-2-Hydroxy-bicyclo< 2.2.2> octan
    • (2S)-bicyclo[2.2.2]octan-2-ol
    • 40335-86-2
    • (s)-qinoclidinole
    • Inchi： 1S/C8H14O/c9-8-5-6-1-3-7(8)4-2-6/h6-9H,1-5H2/t6?,7?,8-/m0/s1
    • InChI Key： BDNQWBJLWGNPAL-RRQHEKLDSA-N
    • SMILES： O[C@H]1CC2CCC1CC2

Computed Properties

  • Exact Mass: 126.10452
  • Monoisotopic Mass: 126.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 103
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23

(s)-qinoclidinole Related Literature

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