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Home > Nitro Compounds > 13675-92-8
13675-92-8 | Quinoline, 6-nitro-, 1-oxide
CAS No: 13675-92-8 Catalog No: AG0012AS MDL No:MFCD01685433
Product Description
Catalog Number:
AG0012AS
Chemical Name:
Quinoline, 6-nitro-, 1-oxide
CAS Number:
13675-92-8
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD01685433
IUPAC Name:
6-nitro-1-oxidoquinolin-1-ium
InChI:
InChI=1S/C9H6N2O3/c12-10-5-1-2-7-6-8(11(13)14)3-4-9(7)10/h1-6H
InChI Key:
FABIKJYANKLSLU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)ccc[n+]2[O-]
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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