5583-11-9

5583-11-9 structure

5583-11-9 structure

Name: (1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide
Chemical Name: (1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide
CAS Number: 5583-11-9
Molecular Formula: C₁₃H₁₇BrN₂O
Molecular Weight: 297.19100
Create Date: 2017-04-14 10:08:22
Modify Date: 2024-01-23 20:35:23

Name	(1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide
Synonyms	(-)-cis-3-Imino-hexahydro-1-phenyl-3H-oxazolo(3,4-a)pyridine,hydrobromide (1R,8aR)-1-phenyl-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide 3H-Oxazolo(3,4-a)pyridine,hexahydro-3-imino-1-phenyl-,hydrobromide,(Z)-(-)

Molecular Formula	C₁₃H₁₇BrN₂O
Molecular Weight	297.19100
Exact Mass	296.05200
PSA	36.32000
LogP	3.54290

CHEMICAL IDENTIFICATION

RTECS NUMBER :: RQ5833505

CHEMICAL NAME :: 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrobromide, (Z)-(-)-

CAS REGISTRY NUMBER :: 5583-11-9

LAST UPDATED :: 199403

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C13-H16-N2-O.Br-H

MOLECULAR WEIGHT :: 297.23

WISWESSER LINE NOTATION :: T56 ANYOTJ BUM DR -L -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 :: 190 mg/kg

TOXIC EFFECTS :: Brain and Coverings - recordings from specific areas of CNS Autonomic Nervous System - sympathomimetic 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 :: 50 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

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: 13,127,1978