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18189-51-0

18189-51-0 structure

18189-51-0 structure

Name: dimethyl-[3-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]propyl]azanium,dichloride
Chemical Name: dimethyl-[3-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]propyl]azanium,dichloride
CAS Number: 18189-51-0
Molecular Formula: C₁₂H₂₀Cl₂N₂O
Molecular Weight: 279.20600
Create Date: 2016-09-17 09:55:35
Modify Date: 2024-04-03 15:56:51

Name	dimethyl-[3-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]propyl]azanium,dichloride
Synonyms	2-((3-(Dimethylamino)propyl)amino)-2,4,6-cycloheptatrien-1-one dihydrochloride 2,4,6-Cycloheptatrien-1-one,2-((3-(dimethylamino)propyl)amino)-,dihydrochloride 2-(3-Dimethylaminopropylamino)tropone dihydrochloride dimethyl-[3-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]propyl]azanium dichloride

Molecular Formula	C₁₂H₂₀Cl₂N₂O
Molecular Weight	279.20600
Exact Mass	278.09500
PSA	32.34000
LogP	3.08740
Vapour Pressure	2.71E-05mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GU4058000

CHEMICAL NAME :: 2,4,6-Cycloheptatrien-1-one, 2-((3-(dimethylamino)propyl)amino)-, dihydrochloride

CAS REGISTRY NUMBER :: 18189-51-0

LAST UPDATED :: 198202

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H18-N2-O.2Cl-H

MOLECULAR WEIGHT :: 279.24

WISWESSER LINE NOTATION :: L7VJ BM3N1&1 &GH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 160 mg/kg

TOXIC EFFECTS :: Behavioral - tremor Vascular - BP lowering not characterized in autonomic section Lungs, Thorax, or Respiration - respiratory stimulation

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 10,1144,1967