| CAS Number | 374794-75-9 |
| Catalog Number | AG00I7DP(AGN-PC-0WNH76) |
| Chemical Name | trans-tert-Butyl 3-hydroxy-4-methylpiperidine-1-carboxylate |
| IUPAC Name | tert-butyl (3S,4R)-3-hydroxy-4-methylpiperidine-1-carboxylate |
| InChI | InChI=1S/C11H21NO3/c1-8-5-6-12(7-9(8)13)10(14)15-11(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9-/m1/s1 |
| InChI Key | ADHBFIMXBSFQLJ-RKDXNWHRSA-N |
| MDL Number | MFCD18791214 |
| Molecular Formula | C11H21NO3 |
| Molecular Weight | 215.2893 |
| SMILES | O=C(N1C[C@H](O)[C@@H](C)CC1)OC(C)(C)C |
| Synonyms | 374794-75-9,
trans-3-Hydroxy-4-methylpiperidine-1-carboxylic acid tert-butyl ester,
tert-butyl trans-3-hydroxy-4-methylpiperidine-1-carboxylate,
SCHEMBL376220,
ADHBFIMXBSFQLJ-RKDXNWHRSA-N,
MFCD18791214,
ZINC40443117,
AS-39739,
trans-1-Boc-3-Hydroxy-4-methylpiperidine,
AJ-102431,
TERT-BUTYL (3R,4S)-3-HYDROXY-4-METHYLPIPERIDINE-1-CARBOXYLATE,
trans-3-Hydroxy-4-methyl-piperidine-1-carboxylic acid tert-butyl ester,
tert-butyl (3R,4S)-rel-3-hydroxy-4-methylpiperidine-1-carboxylate,
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| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.293g/mol |
| Monoisotopic Mass | 215.152g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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