| CAS Number | 1051383-44-8 |
| Catalog Number | AG01EJWL |
| Chemical Name | 3',4'-dihydrospiro[piperidine-4,2'-pyrano[3,2-b]pyridine]-4'-one dihydrochloride |
| IUPAC Name | spiro[3H-pyrano[3,2-b]pyridine-2,4'-piperidine]-4-one;dihydrochloride |
| InChI | InChI=1S/C12H14N2O2.2ClH/c15-9-8-12(3-6-13-7-4-12)16-10-2-1-5-14-11(9)10;;/h1-2,5,13H,3-4,6-8H2;2*1H |
| InChI Key | OJHOGAIDGCNVLX-UHFFFAOYSA-N |
| MDL Number | MFCD31616777 |
| Molecular Formula | C12H16Cl2N2O2 |
| Molecular Weight | 291.1736 |
| SMILES | Cl.Cl.O=C1C2=C(C=CC=N2)OC2(CCNCC2)C1 |
| Synonyms | SCHEMBL3493117,
3',4'-dihydrospiro[piperidine-4,2'-pyrano[3,2-b]pyridine]-4'-one dihydrochloride,
1051383-44-8,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 291.172g/mol |
| Monoisotopic Mass | 290.059g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 51.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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