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82342-93-6 | 4,4'-BIQUINOLINIUM, 1,1'-DIMETHYL-
CAS No: 82342-93-6 Catalog No: AG008KKI MDL No:
Product Description
Catalog Number:
AG008KKI
Chemical Name:
4,4'-BIQUINOLINIUM, 1,1'-DIMETHYL-
CAS Number:
82342-93-6
Molecular Formula:
C20H18N2++
Molecular Weight:
286.3703
IUPAC Name:
1-methyl-4-(1-methylquinolin-1-ium-4-yl)quinolin-1-ium
InChI:
InChI=1S/C20H18N2/c1-21-13-11-15(17-7-3-5-9-19(17)21)16-12-14-22(2)20-10-6-4-8-18(16)20/h3-14H,1-2H3/q+2
InChI Key:
SFSFRMTXEMGWQD-UHFFFAOYSA-N
SMILES:
C[n+]1ccc(c2c1cccc2)c1cc[n+](c2c1cccc2)C
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.147g/mol
Formal Charge:
2
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.378g/mol
Monoisotopic Mass:
286.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
7.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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