| CAS Number | 849767-19-7 |
| Catalog Number | AG00GLSF(AGN-PC-0UW4W6) |
| Chemical Name | TERT-BUTYL 4-HYDROXY-3-(HYDROXYMETHYL)PIPERIDINE-1-CARBOXYLATE |
| IUPAC Name | tert-butyl 4-hydroxy-3-(hydroxymethyl)piperidine-1-carboxylate |
| InChI | InChI=1S/C11H21NO4/c1-11(2,3)16-10(15)12-5-4-9(14)8(6-12)7-13/h8-9,13-14H,4-7H2,1-3H3 |
| InChI Key | NOXASSDKQGKFKZ-UHFFFAOYSA-N |
| MDL Number | MFCD24467008 |
| Molecular Formula | C11H21NO4 |
| Molecular Weight | 231.2887 |
| SMILES | O=C(N1CC(CO)C(O)CC1)OC(C)(C)C |
| Synonyms | tert-Butyl 4-hydroxy-3-(hydroxymethyl)piperidine-1-carboxylate,
849767-19-7,
SCHEMBL534801,
tert-Butyl cis-4-hydroxy-3-(hydroxymethyl)piperidine-1-carboxylate,
tert-Butyl trans-4-hydroxy-3-(hydroxymethyl)piperidine-1-carboxylate,
KS-00001AUM,
NOXASSDKQGKFKZ-UHFFFAOYSA-N,
N-Boc-3-hydroxymethyl-4-piperidol,
1610035-55-6,
1622258-71-2,
MFCD24467008,
CS-0047344,
t-Butyl 4-hydroxy-3-(hydroxymethyl)piperidine-1-carboxylate,
4-hydroxy-3-hydroxymethyl-piperidine-1-carboxylic acid tert-butyl ester,
tert-Butyl (3S,4S)-4-hydroxy-3-(hydroxymethyl)piperidine-1-carboxylate,
220223-48-3,
1259040-13-5,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.292g/mol |
| Monoisotopic Mass | 231.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 70A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number