| CAS Number | 1512564-05-4 |
| Catalog Number | AG01B690 |
| Chemical Name | 3-(2-Methylpropyl)-2-oxopyrrolidine-3-carboxylic acid |
| IUPAC Name | 3-(2-methylpropyl)-2-oxopyrrolidine-3-carboxylic acid |
| InChI | InChI=1S/C9H15NO3/c1-6(2)5-9(8(12)13)3-4-10-7(9)11/h6H,3-5H2,1-2H3,(H,10,11)(H,12,13) |
| InChI Key | JIXYLAKQFLQMFA-UHFFFAOYSA-N |
| MDL Number | MFCD30535603 |
| Molecular Formula | C9H15NO3 |
| Molecular Weight | 185.2203 |
| SMILES | CC(CC1(C(O)=O)C(=O)NCC1)C |
| Synonyms | 3-(2-methylpropyl)-2-oxopyrrolidine-3-carboxylic acid,
1512564-05-4,
AKOS022971024,
Z2736427720,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.223g/mol |
| Monoisotopic Mass | 185.105g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number