| CAS Number | 795261-46-0 |
| Catalog Number | AG005895(AGN-PC-0WC5CS) |
| Chemical Name | 3-(3-Fluorobenzyl)piperidine |
| IUPAC Name | 3-[(3-fluorophenyl)methyl]piperidine |
| InChI | InChI=1S/C12H16FN/c13-12-5-1-3-10(8-12)7-11-4-2-6-14-9-11/h1,3,5,8,11,14H,2,4,6-7,9H2 |
| InChI Key | NNRHYTAYBNCEOE-UHFFFAOYSA-N |
| MDL Number | MFCD05863602 |
| Molecular Formula | C12H16FN |
| Molecular Weight | 193.2605 |
| SMILES | FC1=CC(CC2CNCCC2)=CC=C1 |
| Synonyms | 3-(3-Fluorobenzyl)piperidine,
795261-46-0,
3-(3-Fluoro-benzyl)-piperidine,
3-[(3-fluorophenyl)methyl]piperidine,
SCHEMBL3160166,
CTK5E6893,
DTXSID90588807,
9845AE,
MFCD05863602,
AKOS011516994,
AB22609,
RTR-025268,
TR-025268,
BB 0261793,
FT-0681578,
T6670,
I01-15377,
3- -PIPERIDINE,
C12H16FN,
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| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.265g/mol |
| Monoisotopic Mass | 193.127g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number