| CAS Number | 1031391-93-1 |
| Catalog Number | AG01A916 |
| Chemical Name | 5-methyl-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione |
| IUPAC Name | 5-methyl-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione |
| InChI | InChI=1S/C11H9F3N2O3/c1-10(8(17)15-9(18)16-10)6-2-4-7(5-3-6)19-11(12,13)14/h2-5H,1H3,(H2,15,16,17,18) |
| InChI Key | IBJZFCRVVNHVPG-UHFFFAOYSA-N |
| MDL Number | MFCD09933724 |
| Molecular Formula | C11H9F3N2O3 |
| Molecular Weight | 274.1960 |
| SMILES | CC1(C2=CC=C(OC(F)(F)F)C=C2)C(=O)NC(=O)N1 |
| Synonyms | 5-methyl-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione,
1031391-93-1,
AC1Q2D0U,
SCHEMBL542485,
AKOS000174561,
MCULE-6053637728,
NE38274,
EN300-63939,
Z1258992633,
|
| Complexity | 391 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.199g/mol |
| Monoisotopic Mass | 274.057g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
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