RefChem:1068958 structure

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

CAS: 5583-19-7
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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