| CAS Number | 1932492-10-8 |
| Catalog Number | AG01DHFS |
| Chemical Name | (2R,4R)-tert-Butyl 4-hydroxy-2-propionylpyrrolidine-1-carboxylate |
| IUPAC Name | tert-butyl (2R,4R)-4-hydroxy-2-propanoylpyrrolidine-1-carboxylate |
| InChI | InChI=1S/C12H21NO4/c1-5-10(15)9-6-8(14)7-13(9)11(16)17-12(2,3)4/h8-9,14H,5-7H2,1-4H3/t8-,9-/m1/s1 |
| InChI Key | NVUGNNQATMLQPB-RKDXNWHRSA-N |
| MDL Number | MFCD28991891 |
| Molecular Formula | C12H21NO4 |
| Molecular Weight | 243.2994 |
| SMILES | CCC(=O)[C@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C |
| Synonyms | 1932492-10-8,
(2R,4R)-tert-Butyl 4-hydroxy-2-propionylpyrrolidine-1-carboxylate,
MFCD28991891,
AKOS027256427,
ZINC261507922,
CS-0039941,
(2R,4R)-t-Butyl 4-hydroxy-2-propionylpyrrolidine-1-carboxylate,
1-Pyrrolidinecarboxylic acid, 4-hydroxy-2-(1-oxopropyl)-, 1,1-dimethylethyl ester, (2R,4R)-,
|
| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.303g/mol |
| Monoisotopic Mass | 243.147g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number