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63512-61-8 | 1-(3-hydroxypropyl)-2-methylquinolinium iodide
CAS No: 63512-61-8 Catalog No: AG00EYR9 MDL No:
Product Description
Catalog Number:
AG00EYR9
Chemical Name:
1-(3-hydroxypropyl)-2-methylquinolinium iodide
CAS Number:
63512-61-8
IUPAC Name:
3-(2-methylquinolin-1-ium-1-yl)propan-1-ol;iodide
InChI:
InChI=1S/C13H16NO.HI/c1-11-7-8-12-5-2-3-6-13(12)14(11)9-4-10-15;/h2-3,5-8,15H,4,9-10H2,1H3;1H/q+1;/p-1
InChI Key:
DJZYJYIQOORGLQ-UHFFFAOYSA-M
EC Number:
264-288-1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.028g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.181g/mol
Monoisotopic Mass:
329.028g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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