| CAS Number | 1374655-14-7 |
| Catalog Number | AG009IFM(AGN-PC-0WAGKI) |
| Chemical Name | 1-BOC-4-FLUORO-4-METHYLPIPERIDINE |
| IUPAC Name | tert-butyl 4-fluoro-4-methylpiperidine-1-carboxylate |
| InChI | InChI=1S/C11H20FNO2/c1-10(2,3)15-9(14)13-7-5-11(4,12)6-8-13/h5-8H2,1-4H3 |
| InChI Key | DIWUMINDALALEH-UHFFFAOYSA-N |
| MDL Number | MFCD24857172 |
| Molecular Formula | C11H20FNO2 |
| Molecular Weight | 217.2804 |
| SMILES | O=C(N1CCC(C)(F)CC1)OC(C)(C)C |
| Synonyms | tert-Butyl 4-fluoro-4-methylpiperidine-1-carboxylate,
1374655-14-7,
1-Boc-4-fluoro-4-methylpiperidine,
ZINC215759764,
FCH2347318,
AK162081,
AX8294530,
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| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.148g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.284g/mol |
| Monoisotopic Mass | 217.148g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number