| CAS Number | 956796-12-6 |
| Catalog Number | AG019IH9 |
| Chemical Name | 2-chloro-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide |
| IUPAC Name | 2-chloro-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide |
| InChI | InChI=1S/C12H12ClN3O3/c1-12(8-5-3-2-4-6-8)10(18)16(11(19)14-12)15-9(17)7-13/h2-6H,7H2,1H3,(H,14,19)(H,15,17) |
| InChI Key | JXOPSLIUHKRPAC-UHFFFAOYSA-N |
| MDL Number | MFCD04621550 |
| Molecular Formula | C12H12ClN3O3 |
| Molecular Weight | 281.6950 |
| SMILES | CC1(C2=CC=CC=C2)C(=O)N(NC(CCl)=O)C(=O)N1 |
| Synonyms | 2-chloro-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide,
956796-12-6,
2-Chloro-N-(4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl)-acetamide,
AC1MWOTB,
AC1Q2CZR,
CTK6H5969,
AKOS002681280,
AKOS016046684,
MCULE-9958774261,
NE22120,
EN300-06708,
ZINC03278176,
CID3777620,
|
| Complexity | 409 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.696g/mol |
| Monoisotopic Mass | 281.057g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 78.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number