| CAS Number | 1932387-77-3 |
| Catalog Number | AG01DW3P |
| Chemical Name | (2R,4R)-1-(((9H-Fluoren-9-Yl)Methoxy)Carbonyl)-4-Fluoropyrrolidine-2-Carboxylic Acid |
| IUPAC Name | (2R,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C20H18FNO4/c21-12-9-18(19(23)24)22(10-12)20(25)26-11-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,12,17-18H,9-11H2,(H,23,24)/t12-,18-/m1/s1 |
| InChI Key | CJEQUGHYFSTTQT-KZULUSFZSA-N |
| MDL Number | MFCD02684480 |
| Molecular Formula | C20H18FNO4 |
| Molecular Weight | 355.3596 |
| SMILES | C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N1[C@H](C[C@H](C1)F)C(=O)O |
| Synonyms | SCHEMBL18154897,
cis-1-(((9H-Fluoren-9-yl)methoxy)carbonyl)-4-fluoropyrrolidine-2-carboxylic acid,
ZINC35529532,
AKOS030627586,
FT-0679869,
(2R,4R)-1-(((9H-fluoren-9-yl)methoxy)carbonyl)-4-fluoropyrrolidine-2-carboxylic acid,
1932387-77-3,
1228307-81-0,
|
| Complexity | 534 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 355.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 355.365g/mol |
| Monoisotopic Mass | 355.122g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number