| CAS Number | 1627998-04-2 |
| Catalog Number | AG01FMOG(AGN-PC-3H5MP3) |
| Chemical Name | 2-(4,4-Difluoropiperidin-1-yl)acetic acid |
| IUPAC Name | 2-(4,4-difluoropiperidin-1-yl)acetic acid |
| InChI | InChI=1S/C7H11F2NO2/c8-7(9)1-3-10(4-2-7)5-6(11)12/h1-5H2,(H,11,12) |
| InChI Key | UGJLASMURDCZAZ-UHFFFAOYSA-N |
| MDL Number | MFCD30011128 |
| Molecular Formula | C7H11F2NO2 |
| Molecular Weight | 179.1645 |
| SMILES | OC(=O)CN1CCC(F)(F)CC1 |
| Synonyms | 2-(4,4-difluoropiperidin-1-yl)acetic acid,
1627998-04-2,
SCHEMBL16060622,
AKOS024011469,
ZINC212671953,
A1-08764,
F6543-0093,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.167g/mol |
| Monoisotopic Mass | 179.076g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.1 |
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Certificate of Analysis
Lot Number