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99218-67-4 | Quinolinium, 1,1'-(1,5-pentanediyl)bis-, diiodide
CAS No: 99218-67-4 Catalog No: AG00669Z MDL No:
Product Description
Catalog Number:
AG00669Z
Chemical Name:
Quinolinium, 1,1'-(1,5-pentanediyl)bis-, diiodide
CAS Number:
99218-67-4
Molecular Formula:
C23H24I2N2
Molecular Weight:
582.2590
IUPAC Name:
1-(5-quinolin-1-ium-1-ylpentyl)quinolin-1-ium;diiodide
InChI:
InChI=1S/C23H24N2.2HI/c1(6-16-24-18-8-12-20-10-2-4-14-22(20)24)7-17-25-19-9-13-21-11-3-5-15-23(21)25;;/h2-5,8-15,18-19H,1,6-7,16-17H2;2*1H/q+2;;/p-2
InChI Key:
NUYMUQVKAXFMGU-UHFFFAOYSA-L
SMILES:
C(CC[n+]1cccc2c1cccc2)CC[n+]1cccc2c1cccc2.[I-].[I-]
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
582.003g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
582.268g/mol
Monoisotopic Mass:
582.003g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
7.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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