| CAS Number | 160867-99-2 |
| Catalog Number | AG00B9FT(AGN-PC-0Q7YUA) |
| Chemical Name | L-Proline, 2-methyl-5-oxo- (9CI) |
| IUPAC Name | (2S)-2-methyl-5-oxopyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C6H9NO3/c1-6(5(9)10)3-2-4(8)7-6/h2-3H2,1H3,(H,7,8)(H,9,10)/t6-/m0/s1 |
| InChI Key | OGAOOVOPBAWHDG-LURJTMIESA-N |
| MDL Number | MFCD19229836 |
| Molecular Formula | C6H9NO3 |
| Molecular Weight | 143.1406 |
| SMILES | O=C1CC[C@@](N1)(C)C(=O)O |
| Synonyms | 160867-99-2,
(S)-2-Methyl-5-oxopyrrolidine-2-carboxylic acid,
2-methylpyroglutamic acid,
alpha-methylpyroglutamic acid,
(S)-2-Methylpyroglutamic acid,
OGAOOVOPBAWHDG-LURJTMIESA-N,
ZINC39072811,
AKOS006380242,
DA-04775,
2-methyl-5-oxoProline,
L-Proline, 2-methyl-5-oxo- (9CI),
(2S)-2-METHYL-5-OXOPYRROLIDINE-2-CARBOXYLIC ACID,
64520-50-9,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.142g/mol |
| Monoisotopic Mass | 143.058g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number