| CAS Number | 1004618-90-9 |
| Catalog Number | AG01C49I |
| Chemical Name | Piperidine, 4-(2,3-difluorophenyl)-, hydrochloride (1:1) |
| IUPAC Name | 4-(2,3-difluorophenyl)piperidine;hydrochloride |
| InChI | InChI=1S/C11H13F2N.ClH/c12-10-3-1-2-9(11(10)13)8-4-6-14-7-5-8;/h1-3,8,14H,4-7H2;1H |
| InChI Key | ARNYSAQZKUFZSY-UHFFFAOYSA-N |
| MDL Number | MFCD28972408 |
| Molecular Formula | C11H14ClF2N |
| Molecular Weight | 233.6854 |
| SMILES | FC1=C(F)C(C2CCNCC2)=CC=C1.[H]Cl |
| Synonyms | 1004618-90-9,
4-(2,3-difluorophenyl)piperidine hydrochloride,
SCHEMBL4893603,
MFCD28972408,
4-(2,3-DIFLUOROPHENYL)PIPERIDINE HCL,
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| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.687g/mol |
| Monoisotopic Mass | 233.078g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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