4-(3,4-dimethyl-5-octyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline,iodide

Names

[ Name ]:
4-(3,4-dimethyl-5-octyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline,iodide

[Synonym ]:
2-(p-(Dimethylamino)phenyl)-3,4-dimethyl-5-octyl-thiazolium iodide
2-[4-(dimethylamino)phenyl]-3,4-dimethyl-5-octyl-1,3-thiazol-3-ium iodide
Thiazolium,2-(p-(dimethylamino)phenyl)-3,4-dimethyl-5-octyl-,iodide

Chemical & Physical Properties

[ Molecular Formula ]:
C₂₁H₃₃IN₂S

[ Molecular Weight ]:
472.47000

[ Exact Mass ]:
472.14100

[ PSA ]:
36.18000

[ LogP ]:
1.57290

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XJ7035000

CHEMICAL NAME :: Thiazolium, 2-(p-(dimethylamino)phenyl)-3,4-dimethyl-5-octyl-, iodide

CAS REGISTRY NUMBER :: 21176-92-1

LAST UPDATED :: 198405

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C21-H33-N2-S.I

MOLECULAR WEIGHT :: 472.52

WISWESSER LINE NOTATION :: T5K CSJ A1 BR DN1&1& D8 E1 &I

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 150 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: 11,1205,1968

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 10 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: 11,1205,1968

Related Compounds

5-((6-Fluorobenzo[d]thiazol-2-yl)amino)-2-hydroxybenzoic acid
(2-Methylthiazolidin-4-yl)methanamine
Lithium 2-benzyl-2-(bicyclo[1.1.0]butan-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-uide
tert-Butyl (2S,6R)-6-formyl-2-isobutyl-3-oxopiperazine-1-carboxylate
7-Fluoro-1-hydroxy-3,3-dimethyl-1,3-dihydrobenzo[c][1,2]oxaborole-5-carbaldehyde
tert-Butyl (4-iodo-7-methylbenzo[d]thiazol-2-yl)carbamate
rac-[(1R,3R)-2,2-dimethyl-3-[5-(trifluoromethyl)pyridin-2-yl]cyclopropyl]methanamine
2-Fluoro-2-(2-methylpyridin-4-yl)ethan-1-amine
1-(6-Chloro-4,5-dimethylpyridin-3-yl)ethan-1-ol
1-[2-(3,3-Dimethylcyclohexyl)ethyl]cyclopropan-1-amine

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