| CAS Number | 937603-12-8 |
| Catalog Number | AG019NAR |
| Chemical Name | ethyl 1-(2,2,2-trifluoroethyl)piperidine-4-carboxylate |
| IUPAC Name | ethyl 1-(2,2,2-trifluoroethyl)piperidine-4-carboxylate |
| InChI | InChI=1S/C10H16F3NO2/c1-2-16-9(15)8-3-5-14(6-4-8)7-10(11,12)13/h8H,2-7H2,1H3 |
| InChI Key | HABROCUKQIDAGZ-UHFFFAOYSA-N |
| MDL Number | MFCD08696610 |
| Molecular Formula | C10H16F3NO2 |
| Molecular Weight | 239.2347 |
| SMILES | CCOC(C1CCN(CC(F)(F)F)CC1)=O |
| Synonyms | ethyl 1-(2,2,2-trifluoroethyl)piperidine-4-carboxylate,
937603-12-8,
AC1Q34JK,
SCHEMBL3212302,
CTK6F6917,
HABROCUKQIDAGZ-UHFFFAOYSA-N,
MFCD08696610,
ZINC20348956,
AKOS000314237,
NE49026,
EN300-39842,
Ethyl 1-(2,2,2-trifluoroethyl)-4-piperidinecarboxylate,
1-2 weeks,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.113g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.238g/mol |
| Monoisotopic Mass | 239.113g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number