| CAS Number | 955288-06-9 |
| Catalog Number | AG006078(AGN-PC-01A9CQ) |
| Chemical Name | 3-(3-Fluoro-4-methyl-benzyl)-piperidine |
| IUPAC Name | 3-[(3-fluoro-4-methylphenyl)methyl]piperidine |
| InChI | InChI=1S/C13H18FN/c1-10-4-5-11(8-13(10)14)7-12-3-2-6-15-9-12/h4-5,8,12,15H,2-3,6-7,9H2,1H3 |
| InChI Key | SLWUPZOJGRKMMK-UHFFFAOYSA-N |
| MDL Number | MFCD05863617 |
| Molecular Formula | C13H18FN |
| Molecular Weight | 207.2871 |
| SMILES | CC1=C(F)C=C(CC2CNCCC2)C=C1 |
| Synonyms | 3-(3-Fluoro-4-methyl-benzyl)-piperidine,
955288-06-9,
CTK5H7803,
DTXSID00588818,
MFCD05863617,
AKOS024079874,
AB22635,
PC404530,
RT-008354,
T6846,
3-[(3-fluoro-4-methylphenyl)methyl]piperidine,
3- -PIPERIDINE,
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| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.292g/mol |
| Monoisotopic Mass | 207.142g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number