| CAS Number | 1568002-74-3 |
| Catalog Number | AG01DVPE |
| Chemical Name | [(2S)-1-(2,2-difluoroethyl)pyrrolidin-2-yl]methanol |
| IUPAC Name | [1-(2,2-difluoroethyl)pyrrolidin-2-yl]methanol |
| InChI | InChI=1S/C7H13F2NO/c8-7(9)4-10-3-1-2-6(10)5-11/h6-7,11H,1-5H2 |
| InChI Key | GQZMHXIIQNHRCZ-UHFFFAOYSA-N |
| MDL Number | MFCD21645548 |
| Molecular Formula | C7H13F2NO |
| Molecular Weight | 165.1810 |
| SMILES | FC(CN1[C@@H](CCC1)CO)F |
| Synonyms | [1-(2,2-difluoroethyl)pyrrolidin-2-yl]methanol,
1248925-52-1,
1568002-74-3,
[(2S)-1-(2,2-difluoroethyl)pyrrolidin-2-yl]methanol,
AKOS011289246,
[(2R)-1-(2,2-difluoroethyl)pyrrolidin-2-yl]methanol,
1568029-94-6,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.097g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.184g/mol |
| Monoisotopic Mass | 165.097g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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