| CAS Number | 14059-26-8 |
| Catalog Number | AG019WU2 |
| Chemical Name | 1-(4-acetylphenyl)-5-methyl-2,3-dihydro-1H-imidazol-2-one |
| IUPAC Name | 3-(4-acetylphenyl)-4-methyl-1H-imidazol-2-one |
| InChI | InChI=1S/C12H12N2O2/c1-8-7-13-12(16)14(8)11-5-3-10(4-6-11)9(2)15/h3-7H,1-2H3,(H,13,16) |
| InChI Key | SNRDGILDFOAKTE-UHFFFAOYSA-N |
| MDL Number | MFCD12913209 |
| Molecular Formula | C12H12N2O2 |
| Molecular Weight | 216.2359 |
| SMILES | CC(C1=CC=C(N2C(=O)NC=C2C)C=C1)=O |
| Synonyms | 1-(4-acetylphenyl)-5-methyl-2,3-dihydro-1H-imidazol-2-one,
14059-26-8,
AC1Q1JOL,
CTK5J9607,
ZINC38342137,
AKOS023772111,
MCULE-5722153854,
NE15658,
EN300-53149,
|
| Complexity | 341 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.24g/mol |
| Monoisotopic Mass | 216.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number