| CAS Number | 287942-19-2 |
| Catalog Number | AG01FF7P(AGN-PC-3H4A4F) |
| Chemical Name | 3-Methyl-4-nitrobenzamidoxime |
| IUPAC Name | N'-hydroxy-3-methyl-4-nitrobenzenecarboximidamide |
| InChI | InChI=1S/C8H9N3O3/c1-5-4-6(8(9)10-12)2-3-7(5)11(13)14/h2-4,12H,1H3,(H2,9,10) |
| InChI Key | SJYZAEXSZLJKBI-UHFFFAOYSA-N |
| MDL Number | MFCD22196320 |
| Molecular Formula | C8H9N3O3 |
| Molecular Weight | 195.1754 |
| SMILES | O/N=C(/c1ccc(c(c1)C)[N+](=O)[O-])\N |
| Synonyms | 3-Methyl-4-nitrobenzamidoxime,
287942-19-2,
SCHEMBL18838994,
MFCD20265243,
AKOS027440234,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 195.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.178g/mol |
| Monoisotopic Mass | 195.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number