Cas no 524-57-2 ((r)-[(2s,5s)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride)

(r)-[(2s,5s)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride structure
524-57-2 structure
Product Name:(r)-[(2s,5s)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride
CAS No:524-57-2
MF:C19H23ClN2O
MW:330.851723909378
CID:1577250
PubChem ID:71300393
Update Time:2025-04-21

(r)-[(2s,5s)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride Chemical and Physical Properties

Names and Identifiers

    • Cinchonidine HCl
    • Cinchonidine monohydrochloride
    • (-)-Cinchonidine hydrochloride
    • EINECS 208-361-8
    • (8alpha,9R)-9-Hydroxycinchonanium chloride
    • UNII-694B15YWQK
    • CINCHONIDINE HYDROCHLORIDE
    • (R)-[(2S,5S)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
    • hydrochloride
    • (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride
    • 2-Quinuclidinemethanol, alpha-4-quinolyl-5-vinyl-
    • IMUHWLVEEVGMBC-YYXOUSRLSA-N
    • 524-57-2
    • (R)-quinolin-4-yl((2S,4S,5R)-5-vinylquinuclidin-2-yl)methanol hydrochloride
    • (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methanol hydrochloride
    • (1R)-Quinolin-4-yl((2S,4S,5R)-5-vinylquinuclidin-2-yl)methanol hydrochloride
    • CINCHONAN-9-OL, HYDROCHLORIDE (1:1), (8.ALPHA.,9R)-
    • Cinchonan-9-ol, monohydrochloride, (8-alpha,9R)-
    • 694B15YWQK
    • Cinchonidinhydrochlorid
    • NS00089592
    • Q27264314
    • CINCHONAN-9-OL, MONOHYDROCHLORIDE, (8.ALPHA.,9R)-
    • Cinchonan-9-ol, hydrochloride (1:1), (8alpha,9R)-
    • DTXCID30122906
    • CINCHONAN-9-OL, MONOHYDROCHLORIDE, (8ALPHA,9R)-
    • DTXSID30200415
    • (r)-[(2s,5s)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride
    • Inchi: 1S/C19H22N2O.ClH/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17;/h2-7,9,13-14,18-19,22H,1,8,10-12H2;1H/t13-,14-,18-,19+;/m0./s1
    • InChI Key: IMUHWLVEEVGMBC-YYXOUSRLSA-N
    • SMILES: Cl.O[C@H](C1C=CN=C2C=CC=CC=12)[C@@H]1C[C@@H]2CCN1C[C@@H]2C=C

Computed Properties

  • Exact Mass: 330.1498911g/mol
  • Monoisotopic Mass: 330.1498911g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 3
  • Complexity: 412
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 36.4?2

Experimental Properties

  • Melting Point: 208-218 C

(r)-[(2s,5s)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;hydrochloride Security Information

  • Hazardous Material transportation number:UN 1230 3/PG 2
  • WGK Germany:3
  • Hazard Category Code: 23/24/25-36/37/38
  • Safety Instruction: 36/37/39-45-36-26
  • RTECS:GD2962000
  • Hazardous Material Identification: T Xi
  • HazardClass:6.1(b)
  • PackingGroup:III
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