| CAS Number | 1012040-98-0 |
| Catalog Number | AG01BFN5(AGN-PC-0WOQVY) |
| Chemical Name | 1-(3-Acetylphenyl)imidazolidin-2-one |
| IUPAC Name | 1-(3-acetylphenyl)imidazolidin-2-one |
| InChI | InChI=1S/C11H12N2O2/c1-8(14)9-3-2-4-10(7-9)13-6-5-12-11(13)15/h2-4,7H,5-6H2,1H3,(H,12,15) |
| InChI Key | UZFFTBDDWBVGFL-UHFFFAOYSA-N |
| MDL Number | MFCD23745056 |
| Molecular Formula | C11H12N2O2 |
| Molecular Weight | 204.2252 |
| SMILES | CC(C1=CC(N2C(=O)NCC2)=CC=C1)=O |
| Synonyms | 1-(3-acetylphenyl)imidazolidin-2-one,
1012040-98-0,
SCHEMBL2883293,
UZFFTBDDWBVGFL-UHFFFAOYSA-N,
ZINC86662542,
1-(3-Acetylphenyl)-2-imidazolidinone,
AKOS018226727,
NE61713,
Z1891697113,
|
| Complexity | 278 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.229g/mol |
| Monoisotopic Mass | 204.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number