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21446-46-8 | (S)-1-METHYLNICOTINIUM IODIDE
CAS No: 21446-46-8 Catalog No: AG00C310 MDL No:
Product Description
Catalog Number:
AG00C310
Chemical Name:
(S)-1-METHYLNICOTINIUM IODIDE
CAS Number:
21446-46-8
IUPAC Name:
1-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]pyridin-1-ium;iodide
InChI:
InChI=1S/C11H17N2.HI/c1-12-7-3-5-10(9-12)11-6-4-8-13(11)2;/h3,5,7,9,11H,4,6,8H2,1-2H3;1H/q+1;/p-1/t11-;/m0./s1
InChI Key:
DYAGPCQOMOCCFX-MERQFXBCSA-M
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
304.044g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.175g/mol
Monoisotopic Mass:
304.044g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
7.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| QSAR study on maximal inhibition (Imax) of quaternary ammonium antagonists for S-(-)-nicotine-evoked dopamine release from dopaminergic nerve terminals in rat striatum. | Bioorganic & medicinal chemistry 20090701 |
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