| CAS Number | 1556704-67-6 |
| Catalog Number | AG01BF4Q |
| Chemical Name | 1-[3-(propan-2-yl)phenyl]imidazolidin-2-one |
| IUPAC Name | 1-(3-propan-2-ylphenyl)imidazolidin-2-one |
| InChI | InChI=1S/C12H16N2O/c1-9(2)10-4-3-5-11(8-10)14-7-6-13-12(14)15/h3-5,8-9H,6-7H2,1-2H3,(H,13,15) |
| InChI Key | KGYNXIXMQQROLX-UHFFFAOYSA-N |
| MDL Number | MFCD23696653 |
| Molecular Formula | C12H16N2O |
| Molecular Weight | 204.2682 |
| SMILES | CC(C1=CC(N2C(=O)NCC2)=CC=C1)C |
| Synonyms | 1-[3-(propan-2-yl)phenyl]imidazolidin-2-one,
1556704-67-6,
SCHEMBL14340686,
ZINC98096552,
AKOS033647545,
NE34825,
Z1888396963,
|
| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.273g/mol |
| Monoisotopic Mass | 204.126g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number