| CAS Number | 71636-07-2 |
| Catalog Number | AG01B7I4 |
| Chemical Name | 1-Methyl-5-nitroquinolin-1-ium iodide |
| IUPAC Name | 1-methyl-5-nitroquinolin-1-ium;iodide |
| InChI | InChI=1S/C10H9N2O2.HI/c1-11-7-3-4-8-9(11)5-2-6-10(8)12(13)14;/h2-7H,1H3;1H/q+1;/p-1 |
| InChI Key | CZWVDQJRKFSOAG-UHFFFAOYSA-M |
| MDL Number | MFCD22125887 |
| Molecular Formula | C10H9IN2O2 |
| Molecular Weight | 316.0951 |
| SMILES | [I-].C[N+]1=C2C(C([N+]([O-])=O)=CC=C2)=CC=C1 |
| Synonyms | 1-methyl-5-nitroquinolin-1-ium iodide,
1-Methyl-5-nitroquinolinium iodide,
71636-07-2,
SCHEMBL2073151,
CZWVDQJRKFSOAG-UHFFFAOYSA-M,
5-Nitro-1-methylquinolinium iodide,
AKOS015953376,
MCULE-6145175034,
Z2630948986,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 315.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 316.098g/mol |
| Monoisotopic Mass | 315.971g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number