| CAS Number | 872107-93-2 |
| Catalog Number | AG019OTO |
| Chemical Name | 1-[(thiophen-2-yl)methyl]imidazolidine-2,4,5-trione |
| IUPAC Name | 1-(thiophen-2-ylmethyl)imidazolidine-2,4,5-trione |
| InChI | InChI=1S/C8H6N2O3S/c11-6-7(12)10(8(13)9-6)4-5-2-1-3-14-5/h1-3H,4H2,(H,9,11,13) |
| InChI Key | XCEJXYMMXQBUBL-UHFFFAOYSA-N |
| MDL Number | MFCD07686059 |
| Molecular Formula | C8H6N2O3S |
| Molecular Weight | 210.2098 |
| SMILES | O=C1N(CC2SC=CC=2)C(=O)C(=O)N1 |
| Synonyms | 1-(thiophen-2-ylmethyl)imidazolidine-2,4,5-trione,
872107-93-2,
1-(thien-2-ylmethyl)imidazolidine-2,4,5-trione,
AC1OFLGL,
AC1Q6G4I,
CTK7H5470,
ZINC4218812,
AKOS009040820,
MCULE-4916995645,
NE37011,
EN300-15191,
1-[(thiophen-2-yl)methyl]imidazolidine-2,4,5-trione,
Z119993918,
ZINC04218812,
CID7131443,
|
| Complexity | 305 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.207g/mol |
| Monoisotopic Mass | 210.01g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 94.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number