| CAS Number | 1202067-34-2 |
| Catalog Number | AG01E7MZ |
| Chemical Name | rac-tert-butyl (3aR,6aS)-2-oxo-hexahydro-2H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate |
| IUPAC Name | tert-butyl (3aS,6aR)-2-oxo-3a,4,6,6a-tetrahydro-3H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate |
| InChI | InChI=1S/C10H16N2O4/c1-10(2,3)16-9(14)12-4-6-7(5-12)15-8(13)11-6/h6-7H,4-5H2,1-3H3,(H,11,13)/t6-,7+/m0/s1 |
| InChI Key | XZAVZXYVYKZUTE-NKWVEPMBSA-N |
| MDL Number | MFCD31614354 |
| Molecular Formula | C10H16N2O4 |
| Molecular Weight | 228.245 |
| SMILES | CC(OC(N1C[C@@H]2[C@@H](NC(O2)=O)C1)=O)(C)C |
| Synonyms | SCHEMBL2192381,
AKOS034818729,
ZINC118265432,
Z2738358099,
tert-butyl (3aS,6aR)-2-oxo-hexahydro-2H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate,
1202067-34-2,
|
| Complexity | 323 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.248g/mol |
| Monoisotopic Mass | 228.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number