| CAS Number | 1211542-18-5 |
| Catalog Number | AG009E8F(AGN-PC-0WRA6T) |
| Chemical Name | tert-Butyl 4-(5-hydroxypyridin-2-yl)piperazine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(5-hydroxypyridin-2-yl)piperazine-1-carboxylate |
| InChI | InChI=1S/C14H21N3O3/c1-14(2,3)20-13(19)17-8-6-16(7-9-17)12-5-4-11(18)10-15-12/h4-5,10,18H,6-9H2,1-3H3 |
| InChI Key | PSCCGROQUOHWRG-UHFFFAOYSA-N |
| MDL Number | MFCD18259530 |
| Molecular Formula | C14H21N3O3 |
| Molecular Weight | 279.3348 |
| SMILES | Oc1ccc(nc1)N1CCN(CC1)C(=O)OC(C)(C)C |
| Synonyms | TERT-BUTYL 4-(5-HYDROXYPYRIDIN-2-YL)PIPERAZINE-1-CARBOXYLATE,
1211542-18-5,
SCHEMBL13279435,
ZINC95616307,
DA-19363,
FT-0729276,
C-0489,
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| Complexity | 335 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.34g/mol |
| Monoisotopic Mass | 279.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 65.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number