| CAS Number | 1881275-89-3 |
| Catalog Number | AG00J3EK(AGN-PC-0WRAV3) |
| Chemical Name | 1-tert-butyl 2-methyl (2S,3R)-3-amino-1,2-pyrrolidinedicarboxylate hydrochloride |
| IUPAC Name | 1-O-tert-butyl 2-O-methyl (2S,3R)-3-aminopyrrolidine-1,2-dicarboxylate;hydrochloride |
| InChI | InChI=1S/C11H20N2O4.ClH/c1-11(2,3)17-10(15)13-6-5-7(12)8(13)9(14)16-4;/h7-8H,5-6,12H2,1-4H3;1H/t7-,8+;/m1./s1 |
| InChI Key | DCVYNKDPLQEJHJ-WLYNEOFISA-N |
| MDL Number | MFCD29049335 |
| Molecular Formula | C11H21ClN2O4 |
| Molecular Weight | 280.7484 |
| SMILES | N1(CC[C@@H](N)[C@H]1C(OC)=O)C(=O)OC(C)(C)C.Cl |
| Synonyms | 1881275-89-3,
1-tert-butyl 2-methyl (2S,3R)-3-amino-1,2-pyrrolidinedicarboxylate hydrochloride,
ZX-CM014599,
MFCD29049335,
AKOS030631318,
1-t-Butyl 2-methyl (2S,3R)-3-amino-1,2-pyrrolidinedicarboxylate hydrochloride,
|
| Complexity | 311 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.119g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.749g/mol |
| Monoisotopic Mass | 280.119g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 81.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number