dimethyl-[3-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]propyl]azanium,dichloride

Names

[ CAS No. ]:
18189-51-0

[ Name ]:
dimethyl-[3-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]propyl]azanium,dichloride

[Synonym ]:
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

Chemical & Physical Properties

[ 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

Toxicological Information

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

Related Compounds

  • 6-Chloro-N-methyl-N-[(1-methylbenzimidazol-2-yl)methyl]pyridine-2-carboxamide
  • 6-Chloro-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-YL)pyridine-2-carboxamide
  • N-[2-(Benzenesulfinyl)ethyl]-6-chloropyridine-2-carboxamide
  • N-(2-Cyano-4-phenylbutan-2-yl)-6-oxo-1H-pyridine-3-carboxamide
  • 5-Cyano-N-(2-cyano-4-phenylbutan-2-yl)-6-methylpyridine-2-carboxamide
  • N-(1-Cyano-1-cyclopropylethyl)-3,4,5-trifluorobenzamide
  • 5-Ethyl-1-methyl-3-(3-nitrophenyl)-1H-1,2,4-triazole
  • 2-(2-Chloro-5-methoxypyridin-4-YL)-6,7-dihydro-1H-pyrrolo[3,2-C]pyridin-4(5H)-one
  • Ethyl 2-(4-aminophenyl)pyrimidine-5-carboxylate
  • Ethyl 2-(phenoxymethyl)pyrimidine-5-carboxylate
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