| CAS Number | 1185712-52-0 |
| Catalog Number | AG00J19L |
| Chemical Name | 1-(4-fluorophenyl)-4-piperidinamine acetate |
| IUPAC Name | acetic acid;1-(4-fluorophenyl)piperidin-4-amine |
| InChI | InChI=1S/C11H15FN2.C2H4O2/c12-9-1-3-11(4-2-9)14-7-5-10(13)6-8-14;1-2(3)4/h1-4,10H,5-8,13H2;1H3,(H,3,4) |
| InChI Key | OJTYOBPWQCFWAC-UHFFFAOYSA-N |
| MDL Number | MFCD11841250 |
| Molecular Formula | C13H19FN2O2 |
| Molecular Weight | 254.3006 |
| SMILES | N1(CCC(CC1)N)C1C=CC(=CC=1)F.C(C)(O)=O |
| Synonyms | 1-(4-Fluorophenyl)-4-piperidinamine acetate,
1185712-52-0,
ZX-CM003580,
MFCD11841250,
MCULE-4919715307,
|
| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.305g/mol |
| Monoisotopic Mass | 254.143g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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