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

Modify Date: 2024-02-04 18:30:42

(7-oxocyclohepta-1,3,5-trien-1-yl)-(2-piperidin-1-ium-1-ylethyl)azanium,dichloride Structure
(7-oxocyclohepta-1,3,5-trien-1-yl)-(2-piperidin-1-ium-1-ylethyl)azanium,dichloride structure
Common Name (7-oxocyclohepta-1,3,5-trien-1-yl)-(2-piperidin-1-ium-1-ylethyl)azanium,dichloride
CAS Number 18189-50-9 Molecular Weight 305.24300
Density N/A Boiling Point N/A
Molecular Formula C14H22Cl2N2O Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (7-oxocyclohepta-1,3,5-trien-1-yl)-(2-piperidin-1-ium-1-ylethyl)azanium,dichloride
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C14H22Cl2N2O
Molecular Weight 305.24300
Exact Mass 304.11100
PSA 32.34000
LogP 3.55950
Vapour Pressure 5.03E-07mmHg at 25°C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU4612000
CHEMICAL NAME :
2,4,6-Cycloheptatrien-1-one, 2-((2-piperidinoethyl)amino)-, dihydrochloride
CAS REGISTRY NUMBER :
18189-50-9
LAST UPDATED :
198202
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H20-N2-O.2Cl-H
MOLECULAR WEIGHT :
305.28
WISWESSER LINE NOTATION :
T6NTJ 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 :
300 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

 Synonyms

2-((2-Piperidinoethyl)amino)-2,4,6-cycloheptatrien-1-one dihydrochloride
2,4,6-CYCLOHEPTATRIEN-1-ONE,2-((2-PIPERIDINOETHYL)AMINO)-,DIHYDROCHLORIDE
(7-oxocyclohepta-1,3,5-trien-1-yl)-(2-piperidin-1-ium-1-ylethyl)azanium dichloride
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