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52181-07-4 | 1-benzyl-4-methylquinolinium chloride
CAS No: 52181-07-4 Catalog No: AG00DOGK MDL No:
Product Description
Catalog Number:
AG00DOGK
Chemical Name:
1-benzyl-4-methylquinolinium chloride
CAS Number:
52181-07-4
IUPAC Name:
1-benzyl-4-methylquinolin-1-ium;chloride
InChI:
InChI=1S/C17H16N.ClH/c1-14-11-12-18(13-15-7-3-2-4-8-15)17-10-6-5-9-16(14)17;/h2-12H,13H2,1H3;1H/q+1;/p-1
InChI Key:
CHVNPOOMQVUQHU-UHFFFAOYSA-M
EC Number:
257-710-0
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.097g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.772g/mol
Monoisotopic Mass:
269.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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