| CAS Number | 2102408-74-0 |
| Catalog Number | AG01DFZR |
| Chemical Name | 2-{[(benzyloxy)carbonyl]({1-[(tert-butoxy)carbonyl]pyrrolidin-3-yl})amino}acetic acid |
| IUPAC Name | 2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]-phenylmethoxycarbonylamino]acetic acid |
| InChI | InChI=1S/C19H26N2O6/c1-19(2,3)27-17(24)20-10-9-15(11-20)21(12-16(22)23)18(25)26-13-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H,22,23) |
| InChI Key | PFAZRPVAXDIMFG-UHFFFAOYSA-N |
| MDL Number | MFCD31555326 |
| Molecular Formula | C19H26N2O6 |
| Molecular Weight | 378.4195 |
| SMILES | CC(OC(N1CC(N(C(OCC2=CC=CC=C2)=O)CC(O)=O)CC1)=O)(C)C |
| Synonyms | 2-(((benzyloxy)carbonyl)(1-(tert-butoxycarbonyl)pyrrolidin-3-yl)amino)acetic acid,
2102408-74-0,
|
| Complexity | 539 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 378.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 378.425g/mol |
| Monoisotopic Mass | 378.179g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 96.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number