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63543-87-3 | 2-methyl-8-quinolinol 1-oxide
CAS No: 63543-87-3 Catalog No: AG00EC1B MDL No:MFCD00168978
Product Description
Catalog Number:
AG00EC1B
Chemical Name:
2-methyl-8-quinolinol 1-oxide
CAS Number:
63543-87-3
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD00168978
IUPAC Name:
2-methyl-1-oxidoquinolin-1-ium-8-ol
InChI:
InChI=1S/C10H9NO2/c1-7-5-6-8-3-2-4-9(12)10(8)11(7)13/h2-6,12H,1H3
InChI Key:
HFRZWXVRWSIHNU-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1[n+]([O-])c(cc2)C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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