| CAS Number | 64464-21-7 |
| Catalog Number | AG019N6T(AGN-PC-05WELR) |
| Chemical Name | 5-Methyl-5-(3-nitrophenyl)imidazolidine-2,4-dione |
| IUPAC Name | 5-methyl-5-(3-nitrophenyl)imidazolidine-2,4-dione |
| InChI | InChI=1S/C10H9N3O4/c1-10(8(14)11-9(15)12-10)6-3-2-4-7(5-6)13(16)17/h2-5H,1H3,(H2,11,12,14,15) |
| InChI Key | FFMGTDIPZUOEEB-UHFFFAOYSA-N |
| MDL Number | MFCD00434900 |
| Molecular Formula | C10H9N3O4 |
| Molecular Weight | 235.1962 |
| SMILES | CC1(C2=CC([N+]([O-])=O)=CC=C2)C(=O)NC(=O)N1 |
| Synonyms | 5-methyl-5-(3-nitrophenyl)imidazolidine-2,4-dione,
64464-21-7,
AC1MD2E1,
Oprea1_513297,
2,4-Imidazolidinedione, 5-methyl-5-(3-nitrophenyl)-,
AC1Q2D03,
CHEMBL3245209,
CTK7H5520,
AKOS000141652,
AKOS017268780,
MCULE-3391464311,
NE11476,
EN300-39547,
SR-01000196779,
SR-01000196779-1,
Z56760893,
CID2829815,
|
| Complexity | 378 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.199g/mol |
| Monoisotopic Mass | 235.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number