| CAS Number | 1308319-48-3 |
| Catalog Number | AG00J28W(AGN-PC-0WB5W8) |
| Chemical Name | (4S)-4-amino-1-methyl-L-proline |
| IUPAC Name | (2S,4S)-4-amino-1-methylpyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C6H12N2O2/c1-8-3-4(7)2-5(8)6(9)10/h4-5H,2-3,7H2,1H3,(H,9,10)/t4-,5-/m0/s1 |
| InChI Key | QAMNOCJJWVAJCX-WHFBIAKZSA-N |
| MDL Number | MFCD18917016 |
| Molecular Formula | C6H12N2O2 |
| Molecular Weight | 144.1717 |
| SMILES | N1(C)C[C@H](C[C@H]1C(O)=O)N |
| Synonyms | (4S)-4-amino-1-methyl-L-proline,
1308319-48-3,
SCHEMBL14077902,
ZX-CM008682,
MFCD18917016,
ZINC67425128,
AKOS027426351,
FCH1052019,
Y-7995,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.174g/mol |
| Monoisotopic Mass | 144.09g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -3.1 |
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Certificate of Analysis
Lot Number