| CAS Number | 1638784-52-7 |
| Catalog Number | AG01B8T5(AGN-PC-0WD8A2) |
| Chemical Name | (3S)-3-(difluoromethoxy)pyrrolidine |
| IUPAC Name | (3S)-3-(difluoromethoxy)pyrrolidine |
| InChI | InChI=1S/C5H9F2NO/c6-5(7)9-4-1-2-8-3-4/h4-5,8H,1-3H2/t4-/m0/s1 |
| InChI Key | CENPMZAOUBNUCY-BYPYZUCNSA-N |
| MDL Number | MFCD28348114 |
| Molecular Formula | C5H9F2NO |
| Molecular Weight | 137.1279 |
| SMILES | FC(O[C@@H]1CNCC1)F |
| Synonyms | (3S)-3-(difluoromethoxy)pyrrolidine,
1638784-52-7,
(S)-3-(Difluoromethoxy)pyrrolidine,
MFCD28348114,
ZINC95883981,
AKOS030238199,
AS-43302,
|
| Complexity | 89 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.13g/mol |
| Monoisotopic Mass | 137.065g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number