| CAS Number | 104392-63-4 |
| Catalog Number | AG01C3ST(AGN-PC-03ZEYC) |
| Chemical Name | 5-(bromomethyl)-3-(4-chlorophenyl)-1,3-oxazolidin-2-one |
| IUPAC Name | 5-(bromomethyl)-3-(4-chlorophenyl)-1,3-oxazolidin-2-one |
| InChI | InChI=1S/C10H9BrClNO2/c11-5-9-6-13(10(14)15-9)8-3-1-7(12)2-4-8/h1-4,9H,5-6H2 |
| InChI Key | LLLOCFSPYKDCOM-UHFFFAOYSA-N |
| MDL Number | MFCD26929973 |
| Molecular Formula | C10H9BrClNO2 |
| Molecular Weight | 290.541 |
| SMILES | ClC1=CC=C(N2C(=O)OC(CBr)C2)C=C1 |
| Synonyms | 5-(bromomethyl)-3-(4-chlorophenyl)-1,3-oxazolidin-2-one,
104392-63-4,
SCHEMBL9823590,
|
| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 288.951g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 290.541g/mol |
| Monoisotopic Mass | 288.951g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number