| CAS Number | 1303972-96-4 |
| Catalog Number | AG00HS1A(AGN-PC-0WCJPC) |
| Chemical Name | tert-Butyl 4-(Aminomethyl)-3-fluoropiperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(aminomethyl)-3-fluoropiperidine-1-carboxylate |
| InChI | InChI=1S/C11H21FN2O2/c1-11(2,3)16-10(15)14-5-4-8(6-13)9(12)7-14/h8-9H,4-7,13H2,1-3H3 |
| InChI Key | PWWDRFMQLZQJAY-UHFFFAOYSA-N |
| MDL Number | MFCD18909804 |
| Molecular Formula | C11H21FN2O2 |
| Molecular Weight | 232.2950 |
| SMILES | NCC1CCN(CC1F)C(=O)OC(C)(C)C |
| Synonyms | TERT-BUTYL 4-(AMINOMETHYL)-3-FLUOROPIPERIDINE-1-CARBOXYLATE,
1303972-96-4,
(3S,4R)-rel-1-Boc-4-aminomethyl-3-fluoropiperidine,
1237526-35-0,
SCHEMBL2351219,
MFCD18909804,
AKOS024102313,
CS-W001388,
FCH1621926,
PC430123,
t-Butyl 4-(aminomethyl)-3-fluoropiperidine-1-carboxylate,
tert-butyl4-(Aminomethyl)-3-fluoropiperidine-1-carboxylate,
tert-Butyl (3R,4R)-4-(aminomethyl)-3-fluoropiperidine-1-carboxylate,
tert-Butyl (3S,4S)-4-(aminomethyl)-3-fluoropiperidine-1-carboxylate,
1932103-83-7,
2165882-90-4,
1400764-52-4,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.299g/mol |
| Monoisotopic Mass | 232.159g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number