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71349-94-5 | Quinolinium, 1-ethyl-8-hydroxy-, iodide, butylcarbamate
CAS No: 71349-94-5 Catalog No: AG00FURB MDL No:
Product Description
Catalog Number:
AG00FURB
Chemical Name:
Quinolinium, 1-ethyl-8-hydroxy-, iodide, butylcarbamate
CAS Number:
71349-94-5
IUPAC Name:
(1-ethylquinolin-1-ium-8-yl) N-butylcarbamate;iodide
InChI:
InChI=1S/C16H20N2O2.HI/c1-3-5-11-17-16(19)20-14-10-6-8-13-9-7-12-18(4-2)15(13)14;/h6-10,12H,3-5,11H2,1-2H3;1H
InChI Key:
LAOCVWKXSPCRGX-UHFFFAOYSA-N
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
400.065g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
400.26g/mol
Monoisotopic Mass:
400.065g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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