| CAS Number | 1237030-78-2 |
| Catalog Number | AG01C5AN |
| Chemical Name | 1-(4-methylphenyl)-2,3-dihydro-1H-imidazol-2-one |
| IUPAC Name | 3-(4-methylphenyl)-1H-imidazol-2-one |
| InChI | InChI=1S/C10H10N2O/c1-8-2-4-9(5-3-8)12-7-6-11-10(12)13/h2-7H,1H3,(H,11,13) |
| InChI Key | XYWAETGPIAVPSY-UHFFFAOYSA-N |
| MDL Number | MFCD23697044 |
| Molecular Formula | C10H10N2O |
| Molecular Weight | 174.1992 |
| SMILES | CC1=CC=C(N2C(=O)NC=C2)C=C1 |
| Synonyms | 1-(4-methylphenyl)-2,3-dihydro-1H-imidazol-2-one,
1237030-78-2,
SCHEMBL3858469,
XYWAETGPIAVPSY-UHFFFAOYSA-N,
ZINC87665568,
AKOS019146290,
1-(4-Methylphenyl)-4-imidazoline-2-one,
Z2429425504,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.203g/mol |
| Monoisotopic Mass | 174.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number