| CAS Number | 950029-01-3 |
| Catalog Number | AG019L2D |
| Chemical Name | N'-hydroxy-2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethanimidamide |
| IUPAC Name | N'-hydroxy-2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethanimidamide |
| InChI | InChI=1S/C12H13N3O3/c1-17-10-4-2-8(3-5-10)12-14-9(7-18-12)6-11(13)15-16/h2-5,7,16H,6H2,1H3,(H2,13,15) |
| InChI Key | ICAPHUCFFSDVRU-UHFFFAOYSA-N |
| MDL Number | MFCD09802177 |
| Molecular Formula | C12H13N3O3 |
| Molecular Weight | 247.2499 |
| SMILES | COC1=CC=C(C2OC=C(CC(N)=NO)N=2)C=C1 |
| Synonyms | N'-hydroxy-2-[2-(4-methoxyphenyl)-1,3-oxazol-4-yl]ethanimidamide,
950029-01-3,
CTK8A6180,
CTK8G1839,
AKOS033871703,
Z235361369,
|
| Complexity | 290 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.254g/mol |
| Monoisotopic Mass | 247.096g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 93.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number