RefChem:1068958
(1R,8aR)-1-(3-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine;hydrobromide
Also Known As: trans-3-Imino-1-(m-methoxyphenyl)hexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide|3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-(m-methoxyphenyl)-, hydrobromide (E)-|3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-(m-methoxyphenyl)-, hydrobromide (Z)-|Rel-(1R,8aR)-1-(3-methoxyphenyl)hexahydro-3H-oxazolo[3,4-a]pyridin-3-imine hydrobromide|(1R,8aR)-1-(3-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide
| Molecular Formula | C14H19BrN2O2 |
|---|---|
| Molecular Weight | 326.063 g/mol |
| LogP | 3.13367 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.063 |
| Monoisotopic Mass | 326.063 |
| Heavy Atoms | 19 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 5583-19-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)[C@@H]2[C@H]3CCCCN3C(=N)O2.Br |
| InChIKey | NEUFTBBHRLXTMR-OJERSXHUSA-N |
Product Overview
RefChem:1068958 (CAS 5583-19-7), with molecular formula C14H19BrN2O2 and molecular weight 326.063 g/mol. IUPAC: (1R,8aR)-1-(3-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine;hydrobromide.
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