| CAS Number | 1049607-08-0 |
| Catalog Number | AG019MNE |
| Chemical Name | N-[(4-Fluorophenyl)methyl]-1-(N'-hydroxycarbamimidoyl)formamide |
| IUPAC Name | 2-amino-N-[(4-fluorophenyl)methyl]-2-hydroxyiminoacetamide |
| InChI | InChI=1S/C9H10FN3O2/c10-7-3-1-6(2-4-7)5-12-9(14)8(11)13-15/h1-4,15H,5H2,(H2,11,13)(H,12,14) |
| InChI Key | WSCMIQOBEDNEGN-UHFFFAOYSA-N |
| MDL Number | MFCD10686939 |
| Molecular Formula | C9H10FN3O2 |
| Molecular Weight | 211.1930 |
| SMILES | NC(C(NCC1=CC=C(F)C=C1)=O)=NO |
| Synonyms | N-[(4-fluorophenyl)methyl]-1-(N'-hydroxycarbamimidoyl)formamide,
1049607-08-0,
CTK8A5904,
AKOS034258024,
Z380844626,
2-amino-N-(4-fluorobenzyl)-2-(hydroxyimino)acetamide,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.196g/mol |
| Monoisotopic Mass | 211.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 87.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.3 |
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Certificate of Analysis
Lot Number