| CAS Number | 244132-31-8 |
| Catalog Number | AG01BKCL |
| Chemical Name | (2S,4R)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-methoxypyrrolidine-2-carboxylic acid |
| IUPAC Name | 1-(9H-fluoren-9-ylmethoxycarbonyl)-4-methoxypyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C21H21NO5/c1-26-13-10-19(20(23)24)22(11-13)21(25)27-12-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-9,13,18-19H,10-12H2,1H3,(H,23,24) |
| InChI Key | UZEFBAHAZRPPFE-UHFFFAOYSA-N |
| MDL Number | MFCD31591688 |
| Molecular Formula | C21H21NO5 |
| Molecular Weight | 367.3951 |
| SMILES | C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N1[C@@H](C[C@H](C1)OC)C(=O)O |
| Synonyms | (2S,4R)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-methoxypyrrolidine-2-carboxylic acid,
244132-31-8,
AKOS012614451,
1-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-methoxypyrrolidine-2-carboxylic acid,
|
| Complexity | 545 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 367.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 367.401g/mol |
| Monoisotopic Mass | 367.142g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 76.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
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Certificate of Analysis
Lot Number