| CAS Number | 929974-03-8 |
| Catalog Number | AG00GUGX |
| Chemical Name | 2-(1-Methyl-1H-imidazol-2-yl)-1-phenylethanone oxime |
| IUPAC Name | N-[2-(1-methylimidazol-2-yl)-1-phenylethylidene]hydroxylamine |
| InChI | InChI=1S/C12H13N3O/c1-15-8-7-13-12(15)9-11(14-16)10-5-3-2-4-6-10/h2-8,16H,9H2,1H3 |
| InChI Key | XWYIBTNAXPAQLG-UHFFFAOYSA-N |
| MDL Number | MFCD08691267 |
| Molecular Formula | C12H13N3O |
| Molecular Weight | 215.2511 |
| SMILES | ON=C(C1=CC=CC=C1)CC2=NC=CN2C |
| Synonyms | 929974-03-8,
2-(1-Methyl-1H-imidazol-2-yl)-1-phenylethanone oxime,
(1E)-2-(1-methyl-1H-imidazol-2-yl)-1-phenylethanone oxime,
CTK7F2245,
AKOS030648055,
MCULE-5376734391,
Ethanone, 2-(1-methyl-1H-imidazol-2-yl)-1-phenyl-, oxime,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.256g/mol |
| Monoisotopic Mass | 215.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number