| CAS Number | 1339537-11-9 |
| Catalog Number | AG01EHTM |
| Chemical Name | 3-(3,3,3-trifluoropropoxy)piperidine |
| IUPAC Name | 3-(3,3,3-trifluoropropoxy)piperidine |
| InChI | InChI=1S/C8H14F3NO/c9-8(10,11)3-5-13-7-2-1-4-12-6-7/h7,12H,1-6H2 |
| InChI Key | ZRMGDIUIYOZJTK-UHFFFAOYSA-N |
| MDL Number | MFCD20353317 |
| Molecular Formula | C8H14F3NO |
| Molecular Weight | 197.1981 |
| SMILES | FC(CCOC1CNCCC1)(F)F |
| Synonyms | AKOS013893160,
3-(3,3,3-trifluoropropoxy)piperidine,
1339537-11-9,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.201g/mol |
| Monoisotopic Mass | 197.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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