| CAS Number | 89869-36-3 |
| Catalog Number | AG00H31S(AGN-PC-03UR5K) |
| Chemical Name | 3-(2-Bromoethyl)-1,3-oxazolidin-2-one |
| IUPAC Name | 3-(2-bromoethyl)-1,3-oxazolidin-2-one |
| InChI | InChI=1S/C5H8BrNO2/c6-1-2-7-3-4-9-5(7)8/h1-4H2 |
| InChI Key | WDEXBUYVNOGGEE-UHFFFAOYSA-N |
| MDL Number | MFCD11131211 |
| Molecular Formula | C5H8BrNO2 |
| Molecular Weight | 194.0265 |
| SMILES | BrCCN1C(=O)OCC1 |
| Synonyms | 3-(2-BROMO-ETHYL)-OXAZOLIDIN-2-ONE,
89869-36-3,
3-(2-BROMOETHYL)OXAZOLIDIN-2-ONE,
AMOT0176,
SCHEMBL17162612,
WDEXBUYVNOGGEE-UHFFFAOYSA-N,
1938AJ,
ZINC19841240,
2-Oxazolidinone, 3-(2-bromoethyl)-,
AKOS000212472,
AM85060,
3-(2-bromoethyl)-1,3-oxazolidin-2-one,
Z-5577,
C5H8BrNO2,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.028g/mol |
| Monoisotopic Mass | 192.974g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number