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1246242-17-0 | 8-Isopropylquinoline 1-oxide
CAS No: 1246242-17-0 Catalog No: AG00AA6D MDL No:
Product Description
Catalog Number:
AG00AA6D
Chemical Name:
8-Isopropylquinoline 1-oxide
CAS Number:
1246242-17-0
IUPAC Name:
1-oxido-8-propan-2-ylquinolin-1-ium
InChI:
InChI=1S/C12H13NO/c1-9(2)11-7-3-5-10-6-4-8-13(14)12(10)11/h3-9H,1-2H3
InChI Key:
LYLSTLGFFOQSKE-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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