Quinolinium,1-methyl-2-[2-(methylthio)-2-(1-piperidinyl)ethenyl]-, iodide (1:1)

Modify Date: 2024-02-25 21:54:32

Quinolinium,1-methyl-2-[2-(methylthio)-2-(1-piperidinyl)ethenyl]-, iodide (1:1) Structure
Quinolinium,1-methyl-2-[2-(methylthio)-2-(1-piperidinyl)ethenyl]-, iodide (1:1) structure
Common Name Quinolinium,1-methyl-2-[2-(methylthio)-2-(1-piperidinyl)ethenyl]-, iodide (1:1)
CAS Number 88973-10-8 Molecular Weight 426.35800
Density 1.153g/cm3 Boiling Point 466.2ºC at 760 mmHg
Molecular Formula C18H23IN2S Melting Point N/A
MSDS N/A Flash Point 235.8ºC

 Names

Name 1-methyl-2-(2-methylsulfanyl-2-piperidin-1-ylethenyl)quinolin-1-ium
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.153g/cm3
Boiling Point 466.2ºC at 760 mmHg
Molecular Formula C18H23IN2S
Molecular Weight 426.35800
Flash Point 235.8ºC
Exact Mass 426.06300
PSA 32.42000
LogP 0.75350
Index of Refraction 1.644

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VC3961860
CHEMICAL NAME :
Quinolinium, 1-methyl-2-(2-(methylthio)-2-(1-piperidinyl)ethenyl)- , iodide
CAS REGISTRY NUMBER :
88973-10-8
LAST UPDATED :
198706
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H23-N2-S.I
MOLECULAR WEIGHT :
426.39

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 :
5 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
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: 30,57,1987

 Synthetic Route

~90%

Quinolinium,1-methyl-2-[2-(methylthio)-2-(1-piperidinyl)ethenyl]-, iodide (1:1) Structure

Quinolinium,1-m...

CAS#:88973-10-8

Literature: Foye; Kim; Kauffman Journal of Pharmaceutical Sciences, 1983 , vol. 72, # 11 p. 1356 - 1358

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

1-methyl-2-<2-methylthio-2-(1-piperidino)vinyl>-quinolinium iodide
1-Methyl-2-(2-(methylthio)-2-(1-piperidinyl)ethynyl)quinolinium iodide
1-methyl-2-(2-(methylthio)-2-piperidinovinyl)quinolinium
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