| CAS Number | 1795298-56-4 |
| Catalog Number | AG01BFRP(AGN-PC-0WORA8) |
| Chemical Name | 2-Amino-3-Nitropyridine-4-Carboxylic Acid |
| IUPAC Name | 2-amino-3-nitropyridine-4-carboxylic acid |
| InChI | InChI=1S/C6H5N3O4/c7-5-4(9(12)13)3(6(10)11)1-2-8-5/h1-2H,(H2,7,8)(H,10,11) |
| InChI Key | FTZDIAWHCCOBBG-UHFFFAOYSA-N |
| MDL Number | MFCD28118700 |
| Molecular Formula | C6H5N3O4 |
| Molecular Weight | 183.1216 |
| SMILES | NC1=C([N+]([O-])=O)C(C(O)=O)=CC=N1 |
| Synonyms | 2-amino-3-nitropyridine-4-carboxylic acid,
1795298-56-4,
SCHEMBL8567191,
ZINC98209892,
AKOS026741604,
Z1925930613,
|
| Complexity | 226 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.028006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.12g/mol |
| Monoisotopic Mass | 183.028006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 122Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number