| CAS Number | 1094408-14-6 |
| Catalog Number | AG01A95D |
| Chemical Name | 1-[2-(4-methoxyphenyl)ethyl]imidazolidine-2,4,5-trione |
| IUPAC Name | 1-[2-(4-methoxyphenyl)ethyl]imidazolidine-2,4,5-trione |
| InChI | InChI=1S/C12H12N2O4/c1-18-9-4-2-8(3-5-9)6-7-14-11(16)10(15)13-12(14)17/h2-5H,6-7H2,1H3,(H,13,15,17) |
| InChI Key | UOEUPJAWIJGIRE-UHFFFAOYSA-N |
| MDL Number | MFCD11544035 |
| Molecular Formula | C12H12N2O4 |
| Molecular Weight | 248.2347 |
| SMILES | COC1=CC=C(CCN2C(=O)C(=O)NC2=O)C=C1 |
| Synonyms | 1-[2-(4-methoxyphenyl)ethyl]imidazolidine-2,4,5-trione,
1094408-14-6,
AC1Q4CIC,
ZINC36927219,
AKOS009323760,
MCULE-3779662094,
NE22098,
EN300-64232,
Z1262327539,
|
| Complexity | 361 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.238g/mol |
| Monoisotopic Mass | 248.08g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 75.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number