Cas no 3684-26-2 (1-azabicyclo[2.2.2]octan-8-ol)

1-azabicyclo[2.2.2]octan-8-ol structure
1-azabicyclo[2.2.2]octan-8-ol structure
Product Name:1-azabicyclo[2.2.2]octan-8-ol
CAS No:3684-26-2
MF:C7H13NO
MW:127.184221982956
CID:921689
PubChem ID:15381
Update Time:2025-04-19

1-azabicyclo[2.2.2]octan-8-ol Chemical and Physical Properties

Names and Identifiers

    • 1-azabicyclo[2.2.2]octan-8-ol
    • (S)-1-azabicyclo[2.2.2]octan-3-ol
    • HSDB 7710
    • Q0024
    • 3-QUINUCLIDINOL
    • MFCD00151326
    • 3684-26-2
    • AKOS009158263
    • DB-043508
    • Quinuclidinol
    • InChI=1/C7H13NO/c9-7-5-8-3-1-6(7)2-4-8/h6-7,9H,1-5H
    • AB87536
    • SDCCGMLS-0065888.P001
    • quinuclidone-3
    • 3-Quinuclidinol, 99%
    • Q27197086
    • NS00006113
    • (rac.)-3-quinuclidinol
    • F11430
    • 1-Aza-bicyclo[2.2.2]octan-3-ol
    • 1-Azabicyclo[2.2.2]octan-3-ol
    • (RS) 3-quinuclidinol
    • 1619-34-7
    • 3-oxyquinuclidine
    • BDBM50047005
    • (+-)-3-quinuclidinol
    • NSC 93905
    • 3-hydroxy quinuclidine
    • PS-5754
    • Quinuclidinol-3
    • DTXSID50862716
    • UNII-974MVZ0WOK
    • 3-HYDROXYQUINUCLIDINE, (+/-)-
    • 1-azabicyclo[2.2.2]octan-3-ol,hydrochloride
    • 3-Hydroxy Chinuclidin
    • NSC93905
    • 3-QUINUCLIDINOL, DL-
    • 1-Azabicyclo[2.2.2.]octan-3-ol
    • 3-QUINUCLIDINOL DL-FORM [MI]
    • 3-hydroxy-1-azoniabicyclo[2.2.2]octane
    • W-201469
    • (RS)-3-Quinuclidinol
    • 3-quinuclidol
    • CHEMBL276310
    • 3-QUINUCLIDINOL, (+/-)-
    • 974MVZ0WOK
    • 3-Hydroxyquinuclidine
    • Quinuclidine-3-ol
    • 1-Aza-bicyclo[2.2.2]octan-3-ol (3-quinuclidinol)
    • A810307
    • racemic quinuclidin-3-ol
    • CHEBI:115239
    • CS-B0695
    • 3-Quinuclidinol dl-form
    • PD060385
    • SB13175
    • EINECS 216-578-4
    • 3-hydroxychinuclidin
    • DB-082764
    • Quinuclidin-3-ol
    • 3-Hydroxy-1-azabicyclo[2.2.2]octane
    • SCHEMBL66150
    • aza-bicyclo[2.2.2]oct-3-yl alcohol
    • BRN 0104327
    • NSC-93905
    • (+/-)3-Quinuclidinol
    • (+/-)-3-Quinuclidinol
    • 1-Azabicyclo(2.2.2)octan-3-ol
    • Inchi： 1S/C7H13NO/c9-7-5-8-3-1-6(7)2-4-8/h6-7,9H,1-5H2
    • InChI Key： IVLICPVPXWEGCA-UHFFFAOYSA-N
    • SMILES： OC1CN2CCC1CC2

Computed Properties

  • Exact Mass: 127.099714
  • Monoisotopic Mass: 127.099714
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 108
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 23.5
  • XLogP3: 0.2

Experimental Properties

  • Density: 1.13
  • Melting Point: 221 deg C
  • Boiling Point: 206.9°Cat760mmHg
  • Flash Point: 97.7°C
  • PSA: 23.47000
  • LogP: 0.01080

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