| CAS Number | 273222-07-4 |
| Catalog Number | AG01BKBZ |
| Chemical Name | 1-(9H-Fluoren-9-ylmethyl) (2R)-4,4-difluoro-1,2-pyrrolidinedicarboxylate |
| IUPAC Name | 1-(9H-fluoren-9-ylmethoxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C20H17F2NO4/c21-20(22)9-17(18(24)25)23(11-20)19(26)27-10-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-17H,9-11H2,(H,24,25) |
| InChI Key | QLKUZDLPWHCYAO-UHFFFAOYSA-N |
| MDL Number | MFCD01860710 |
| Molecular Formula | C20H17F2NO4 |
| Molecular Weight | 373.3501 |
| SMILES | O=C([C@@H]1N(C(OCC2C3=C(C4=C2C=CC=C4)C=CC=C3)=O)CC(F)(F)C1)O |
| Synonyms | (2R)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4,4-difluoropyrrolidine-2-carboxylic acid,
(S)-1-(((9H-Fluoren-9-yl)methoxy)carbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid,
1-{[(9H-FLUOREN-9-YL)METHOXY]CARBONYL}-4,4-DIFLUOROPYRROLIDINE-2-CARBOXYLIC ACID,
1822492-40-9,
273222-07-4,
Fmoc-4,4-difluoro-D-Proline,
SCHEMBL16095267,
CTK8H5163,
AKOS026739913,
203866-21-1,
N/A,
|
| Complexity | 577 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 373.113g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 373.356g/mol |
| Monoisotopic Mass | 373.113g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number