| CAS Number | 516481-67-7 |
| Catalog Number | AG01FR52(AGN-PC-0WOMY4) |
| Chemical Name | 6-Amino-5-nitropicolinonitrile |
| IUPAC Name | 6-amino-5-nitropyridine-2-carbonitrile |
| InChI | InChI=1S/C6H4N4O2/c7-3-4-1-2-5(10(11)12)6(8)9-4/h1-2H,(H2,8,9) |
| InChI Key | RRPKOJDIMOBIOE-UHFFFAOYSA-N |
| MDL Number | MFCD18072571 |
| Molecular Formula | C6H4N4O2 |
| Molecular Weight | 164.1216 |
| SMILES | |
| Synonyms | 6-amino-5-nitropicolinonitrile,
516481-67-7,
6-amino-5-nitro-pyridine-2-carbonitrile,
SCHEMBL3917265,
RRPKOJDIMOBIOE-UHFFFAOYSA-N,
ZINC64033972,
DB-010158,
FT-0733361,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.033425g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.12g/mol |
| Monoisotopic Mass | 164.033425g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 109Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number