2-morpholin-4-ium-4-ylethyl-(7-oxocyclohepta-1,3,5-trien-1-yl)azanium,dichloride

Names

[ CAS No. ]:
18189-49-6

[ Name ]:
2-morpholin-4-ium-4-ylethyl-(7-oxocyclohepta-1,3,5-trien-1-yl)azanium,dichloride

[Synonym ]:
2-((2-Morpholinoethyl)amino)-2,4,6-cycloheptatrien-1-one dihydrochloride
2-morpholin-4-ium-4-ylethyl-(7-oxocyclohepta-1,3,5-trien-1-yl)azanium dichloride
2,4,6-CYCLOHEPTATRIEN-1-ONE,2-((2-MORPHOLINOETHYL)AMINO)-,DIHYDROCHLORIDE

Chemical & Physical Properties

[ Molecular Formula ]:
C13H20Cl2N2O2

[ Molecular Weight ]:
307.21600

[ Exact Mass ]:
306.09000

[ PSA ]:
41.57000

[ LogP ]:
2.40580

[ Vapour Pressure ]:
1.58E-07mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU4610000
CHEMICAL NAME :
2,4,6-Cycloheptatrien-1-one, 2-((2-morpholinoethyl)amino)-, dihydrochloride
CAS REGISTRY NUMBER :
18189-49-6
LAST UPDATED :
198202
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H18-N2-O2.2Cl-H
MOLECULAR WEIGHT :
307.25
WISWESSER LINE NOTATION :
T6N DOTJ A2M- BL7VJ &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 :
100 mg/kg
TOXIC EFFECTS :
Vascular - relaxation (isolated tissues) Lungs, Thorax, or Respiration - respiratory stimulation Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
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-(Propan-2-yl)piperidine-2,4-dione
  • 4-(1-Hydroxy-2-methylpropan-2-yl)-2-methoxyphenol
  • 3-(hydroxymethyl)-N,5-dimethyl-benzamide
  • 4-(1,1-Difluoro-2-hydroxyethyl)-2-methoxyphenol
  • Ethyl 6-(3-aminoazetidin-1-yl)-5-chloronicotinate
  • 4-Bromo-5-(2-hydroxyethyl)-2-methoxyphenol
  • 3-(3,5-Difluorophenyl)-4,4,4-trifluorobutanoic acid
  • 4-Bromo-5-(1-hydroxy-2-methylpropan-2-yl)-2-methoxyphenol
  • N-[(2-chlorophenyl)methyl]-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
  • 4-Bromo-5-(1,1-difluoro-2-hydroxyethyl)-2-methoxyphenol
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