HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 11368999Generated: November 1, 2026
tert-butyl (2S,3R)-2-[(1S)-1,3-dihydroxypropyl]-3-hydroxypyrrolidine-1-carboxylate
https://huagongshe.com/en/chemical/11368999
Identifiers & Physical Properties
| CAS No. | 548458-39-5 |
|---|
| Molecular formula | C12H23NO5 |
|---|
| Average molar mass | 261.31 g/mol |
|---|
| Monoisotopic mass | 261.15762283 g/mol |
|---|
| SMILES | CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H]1[C@@H](O)CCO |
|---|
| InChIKey | KSEKFZGECJTDAU-UTLUCORTSA-N |
|---|
| PubChem CID | 11368999 |
|---|
| DTXSID | DTXSID801122839 |
|---|
Chemical & Physical Properties
| XLogP | 0.3 |
|---|
| Topological polar surface area | 90.2 |
|---|
| Hydrogen bond donors | 3 |
|---|
| Hydrogen bond acceptors | 5 |
|---|
| Rotatable bonds | 5 |
|---|
| Heavy atoms | 18 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 289 |
|---|
![tert-butyl (2S,3R)-2-[(1S)-1,3-dihydroxypropyl]-3-hydroxypyrrolidine-1-carboxylate molecular structure](/img/chemical/11368999.png)