| CAS Number | 1015946-14-1 |
| Catalog Number | AG018NMP(AGN-PC-04OIWR) |
| Chemical Name | 1-(Benzo[d]oxazol-2-yl)piperidin-4-ol |
| IUPAC Name | 1-(1,3-benzoxazol-2-yl)piperidin-4-ol |
| InChI | InChI=1S/C12H14N2O2/c15-9-5-7-14(8-6-9)12-13-10-3-1-2-4-11(10)16-12/h1-4,9,15H,5-8H2 |
| InChI Key | WKCIKPHFCLGQCT-UHFFFAOYSA-N |
| MDL Number | MFCD10414187 |
| Molecular Formula | C12H14N2O2 |
| Molecular Weight | 218.2518 |
| SMILES | O1C(=NC2=C1C=CC=C2)N2CCC(CC2)O |
| Synonyms | 1-(benzo[d]oxazol-2-yl)piperidin-4-ol,
1015946-14-1,
SCHEMBL12506010,
ZINC22759017,
AKOS001431259,
MCULE-4755553013,
F2167-0814,
1-(1,3-benzoxazol-2-yl)piperidin-4-ol,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.256g/mol |
| Monoisotopic Mass | 218.106g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number