| CAS Number | 1780258-19-6 |
| Catalog Number | AG01BAL4 |
| Chemical Name | 4,4-Difluoropiperidine-3-carboxylic acid hydrochloride |
| IUPAC Name | 4,4-difluoropiperidine-3-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C6H9F2NO2.ClH/c7-6(8)1-2-9-3-4(6)5(10)11;/h4,9H,1-3H2,(H,10,11);1H |
| InChI Key | KJNMUQFWEZPIRA-UHFFFAOYSA-N |
| MDL Number | MFCD28397686 |
| Molecular Formula | C6H10ClF2NO2 |
| Molecular Weight | 201.5989 |
| SMILES | Cl.OC(C1C(F)(F)CCNC1)=O |
| Synonyms | 4,4-difluoropiperidine-3-carboxylic acid hydrochloride,
1780258-19-6,
MFCD28397686,
AKOS024130818,
4,4-DIFLUOROPIPERIDINE-3-CARBOXYLIC ACID HCL,
Z2082999282,
C6H10ClF2NO2,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.598g/mol |
| Monoisotopic Mass | 201.037g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number