(S)-[(2R)-5-ethenyl-1-ethyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;iodide
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![(S)-[(2R)-5-ethenyl-1-ethyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;iodide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/23df34c31bb14621975550122069b76e.png "(S)-[(2R)-5-ethenyl-1-ethyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;iodide")
(S)-[(2R)-5-ethenyl-1-ethyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;iodide
structure -
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CAS No:
73771-80-9
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Formula:
C21H27IN2O
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Chemical Name:
(S)-[(2R)-5-ethenyl-1-ethyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;iodide
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Synonyms:
73771-80-9;Cinchonidine ethiodide;(8-alpha,9R)-9-Hydroxy-ethylcinchonan-1-ium iodide;Cinchonan-1-ium, 1-ethyl-9-hydroxy-, iodide, (8-alpha,9R)-;DTXSID30994701;1-Ethyl-9-hydroxycinchonan-1-ium iodide
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CAS No:
(S)-[(2R)-5-ethenyl-1-ethyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;iodide Basic Attributes
450.4 g/mol
450.11681 g/mol
Computed Properties
Molecular Weight:450.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:450.11681
Monoisotopic Mass:450.11681
Topological Polar Surface Area:33.1
Heavy Atom Count:25
Complexity:467
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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