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Home > Nitro Compounds > 14753-17-4
14753-17-4 | Quinoline, 7-nitro-, 1-oxide
CAS No: 14753-17-4 Catalog No: AG001EYO MDL No:MFCD01685434
Product Description
Catalog Number:
AG001EYO
Chemical Name:
Quinoline, 7-nitro-, 1-oxide
CAS Number:
14753-17-4
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD01685434
IUPAC Name:
7-nitro-1-oxidoquinolin-1-ium
InChI:
InChI=1S/C9H6N2O3/c12-10-5-1-2-7-3-4-8(11(13)14)6-9(7)10/h1-6H
InChI Key:
MUOCQTVDQHFBEA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)[n+]([O-])ccc2
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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