(1R,8aS)-1-(4-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide
Names
[ CAS No. ]:
5583-02-8
[ Name ]:
(1R,8aS)-1-(4-chlorophenyl)-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-1-(p-chlorophenyl)-3-imino-,hydrobromide (Z)
cis-1-(p-Chlorophenyl)-3-iminohexahydro-3H-oxazolo(3,4-a)pyridinehydrobromide
(1R,8aS)-1-(4-chlorophenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide
Chemical & Physical Properties
[ Molecular Formula ]:
C13H16BrClN2O
[ Molecular Weight ]:
331.63600
[ Exact Mass ]:
330.01300
[ PSA ]:
36.32000
[ LogP ]:
4.19630
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- RQ5833182
- CHEMICAL NAME :
- 3H-Oxazolo(3,4-a)pyridine, hexahydro-1-(p-chlorophenyl)-3-imino-,hydrobromide (Z)-
- CAS REGISTRY NUMBER :
- 5583-02-8
- LAST UPDATED :
- 199403
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C13-H15-Cl-N2-O.Br-H
- MOLECULAR WEIGHT :
- 331.67
- WISWESSER LINE NOTATION :
- T56 ANYOTJ BUM DR DG -C &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 :
- 60 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 :
- 28 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