(1R,8aR)-1-(3-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide
Names
[ CAS No. ]:
5583-19-7
[ Name ]:
(1R,8aR)-1-(3-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide
[Synonym ]:
3H-Oxazolo(3,4-a)pyridine,hexahydro-3-imino-1-(m-methoxyphenyl)-,hydrobromide (E)
(1R,8aR)-1-(3-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide
trans-3-Imino-1-(m-methoxyphenyl)hexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide
Chemical & Physical Properties
[ Molecular Formula ]:
C14H19BrN2O2
[ Molecular Weight ]:
327.21700
[ Exact Mass ]:
326.06300
[ PSA ]:
45.55000
[ LogP ]:
3.55150
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- RQ5833187
- CHEMICAL NAME :
- 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-(m-methoxyphenyl)-, hydrobromide (E)-
- CAS REGISTRY NUMBER :
- 5583-19-7
- LAST UPDATED :
- 199403
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C14-H18-N2-O2.Br-H
- MOLECULAR WEIGHT :
- 327.26
- WISWESSER LINE NOTATION :
- T56 ANYOTJ BUM DR CO1 -T &EH
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Brain and Coverings - recordings from specific areas of CNS Behavioral - excitement Vascular - BP elevation not characterized in autonomic section
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,111,1980
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 20 mg/kg
- TOXIC EFFECTS :
- Brain and Coverings - recordings from specific areas of CNS Behavioral - excitement Vascular - BP elevation not characterized in autonomic section
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,111,1980