| CAS Number | 84487-06-9 |
| Catalog Number | AG00G5QC(AGN-PC-09TPNZ) |
| Chemical Name | 6-Amino-5-nitropyridine-2-carboxylic acid |
| IUPAC Name | 6-amino-5-nitropyridine-2-carboxylic acid |
| InChI | InChI=1S/C6H5N3O4/c7-5-4(9(12)13)2-1-3(8-5)6(10)11/h1-2H,(H2,7,8)(H,10,11) |
| InChI Key | HVYVJNJMZVUYDH-UHFFFAOYSA-N |
| MDL Number | MFCD16556246 |
| Molecular Formula | C6H5N3O4 |
| Molecular Weight | 183.1216 |
| SMILES | NC1=C([N+]([O-])=O)C=CC(C(O)=O)=N1 |
| Synonyms | 6-Amino-5-nitropyridine-2-carboxylic acid,
84487-06-9,
DTXSID50704627,
ZINC71256084,
AKOS023398088,
NE50704,
DB-083258,
FT-0703980,
|
| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.123g/mol |
| Monoisotopic Mass | 183.028g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 122A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number