| CAS Number | 561008-72-8 |
| Catalog Number | AG019I7P |
| Chemical Name | 2-(N'-hydroxycarbamimidoyl)-N-(2-methylphenyl)acetamide |
| IUPAC Name | 3-amino-3-hydroxyimino-N-(2-methylphenyl)propanamide |
| InChI | InChI=1S/C10H13N3O2/c1-7-4-2-3-5-8(7)12-10(14)6-9(11)13-15/h2-5,15H,6H2,1H3,(H2,11,13)(H,12,14) |
| InChI Key | IVZFGVGESLEMIQ-UHFFFAOYSA-N |
| MDL Number | MFCD07284617 |
| Molecular Formula | C10H13N3O2 |
| Molecular Weight | 207.2291 |
| SMILES | CC1=C(NC(CC(N)=NO)=O)C=CC=C1 |
| Synonyms | 2-(N'-hydroxycarbamimidoyl)-N-(2-methylphenyl)acetamide,
561008-72-8,
AC1M6MLJ,
CTK8F3665,
3-amino-3-hydroxyimino-N-(2-methylphenyl)propanamide,
Z56928664,
ZINC04801717,
CID2451342,
2-(N-Hydroxycarbamimidoyl)-N-o-tolyl-acetamide,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.233g/mol |
| Monoisotopic Mass | 207.101g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 87.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number