| CAS Number | 1393442-51-7 |
| Catalog Number | AG009WR9(AGN-PC-0WAEJP) |
| Chemical Name | N-Cyclopropyl-5-nitropyridine-2-carboxamide |
| IUPAC Name | N-cyclopropyl-5-nitropyridine-2-carboxamide |
| InChI | InChI=1S/C9H9N3O3/c13-9(11-6-1-2-6)8-4-3-7(5-10-8)12(14)15/h3-6H,1-2H2,(H,11,13) |
| InChI Key | LWLJHXWQCJPKOT-UHFFFAOYSA-N |
| MDL Number | MFCD22383773 |
| Molecular Formula | C9H9N3O3 |
| Molecular Weight | 207.1861 |
| SMILES | O=C(c1ccc(cn1)[N+](=O)[O-])NC1CC1 |
| Synonyms | N-CYCLOPROPYL-5-NITROPYRIDINE-2-CARBOXAMIDE,
1393442-51-7,
KM5538,
ZINC95495959,
V2957,
C9H9N3O3,
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| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.189g/mol |
| Monoisotopic Mass | 207.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 87.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number