| CAS Number | 1517990-29-2 |
| Catalog Number | AG01CAFH |
| Chemical Name | tert-butyl 3-propanoylpyrrolidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-propanoylpyrrolidine-1-carboxylate |
| InChI | InChI=1S/C12H21NO3/c1-5-10(14)9-6-7-13(8-9)11(15)16-12(2,3)4/h9H,5-8H2,1-4H3 |
| InChI Key | QXPODYGRSAPFDR-UHFFFAOYSA-N |
| MDL Number | MFCD14706654 |
| Molecular Formula | C12H21NO3 |
| Molecular Weight | 227.3 |
| SMILES | CCC(C1CN(C(OC(C)(C)C)=O)CC1)=O |
| Synonyms | 3-PROPIONYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER,
1517990-29-2,
AKOS022930749,
|
| Complexity | 281 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.304g/mol |
| Monoisotopic Mass | 227.152g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number