| CAS Number | 1232059-97-0 |
| Catalog Number | AG000K5R(AGN-PC-0WAFFB) |
| Chemical Name | trans-4-AMino-1-Boc-3-Methoxypiperidine |
| IUPAC Name | tert-butyl (3R,4R)-4-amino-3-methoxypiperidine-1-carboxylate |
| InChI | InChI=1S/C11H22N2O3/c1-11(2,3)16-10(14)13-6-5-8(12)9(7-13)15-4/h8-9H,5-7,12H2,1-4H3/t8-,9-/m1/s1 |
| InChI Key | QNGHCFVWYKWWMU-RKDXNWHRSA-N |
| MDL Number | MFCD18711927 |
| Molecular Formula | C11H22N2O3 |
| Molecular Weight | 230.3040 |
| SMILES | CO[C@H]1CN(C(OC(C)(C)C)=O)CC[C@@H]1N |
| Synonyms | TRANS-4-AMINO-1-BOC-3-METHOXYPIPERIDINE,
1232059-97-0,
SCHEMBL10177807,
MFCD18711927,
ZINC32098692,
AKOS024438430,
PB16829,
AJ-84620,
AS-33784,
CS-0047761,
Q-3117,
rel-tert-Butyl (3R,4R)-4-amino-3-methoxypiperidine-1-carboxylate,
1-Piperidinecarboxylic acid, 4-amino-3-methoxy-, 1,1-dimethylethyl ester, (3R,4S)-rel-,
1171124-68-7,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.308g/mol |
| Monoisotopic Mass | 230.163g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number