| CAS Number | 1823794-46-2 |
| Catalog Number | AG019ELM(AGN-PC-0WG4UI) |
| Chemical Name | tert-Butyl 4-(1-benzyl-1H-imidazol-2-yl)-4-hydroxypiperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(1-benzylimidazol-2-yl)-4-hydroxypiperidine-1-carboxylate |
| InChI | InChI=1S/C20H27N3O3/c1-19(2,3)26-18(24)22-12-9-20(25,10-13-22)17-21-11-14-23(17)15-16-7-5-4-6-8-16/h4-8,11,14,25H,9-10,12-13,15H2,1-3H3 |
| InChI Key | AUAMSXDJIQYYFB-UHFFFAOYSA-N |
| MDL Number | MFCD27997367 |
| Molecular Formula | C20H27N3O3 |
| Molecular Weight | 357.4467 |
| SMILES | CC(C)(C)OC(=O)N1CCC(O)(CC1)c1nccn1Cc1ccccc1 |
| Synonyms | 1823794-46-2,
tert-Butyl 4-(1-benzyl-1H-imidazol-2-yl)-4-hydroxypiperidine-1-carboxylate,
MFCD27997367,
ZINC97759017,
CS-0038669,
t-Butyl 4-(1-benzyl-1H-imidazol-2-yl)-4-hydroxypiperidine-1-carboxylate,
Tert-Butyl 4-(1-Benzyl-1H-Imidazol-2-Yl)-4-Hydroxypiperidine-1-Carboxylate(WX160187),
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| Complexity | 477 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 357.205g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 357.454g/mol |
| Monoisotopic Mass | 357.205g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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