| CAS Number | 1864003-22-4 |
| Catalog Number | AG00J3AC(AGN-PC-0WRATU) |
| Chemical Name | rac-(4aR,8aS)-octahydropyrano[3,4-b][1,4]oxazine hydrochloride |
| IUPAC Name | (4aR,8aS)-1,2,3,4a,5,7,8,8a-octahydropyrano[3,4-b][1,4]oxazine;hydrochloride |
| InChI | InChI=1S/C7H13NO2.ClH/c1-3-9-5-7-6(1)8-2-4-10-7;/h6-8H,1-5H2;1H/t6-,7-;/m0./s1 |
| InChI Key | PRYVULQXGABNLD-LEUCUCNGSA-N |
| MDL Number | MFCD28894240 |
| Molecular Formula | C7H14ClNO2 |
| Molecular Weight | 179.6446 |
| SMILES | [C@H]12COCC[C@@H]1NCCO2.Cl |
| Synonyms | 1864003-22-4,
rac-(4aR,8aS)-Octahydropyrano[3,4-b][1,4]oxazine hydrochloride,
(4AR,8AS)-OCTAHYDROPYRANO[3,4-B][1,4]OXAZINE HYDROCHLORIDE,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.071306g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.64g/mol |
| Monoisotopic Mass | 179.071306g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 30.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number