4-(5-ethyl-3-methyl-4-propyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline,iodide

Names

[ CAS No. ]:
21176-91-0

[ Name ]:
4-(5-ethyl-3-methyl-4-propyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline,iodide

[Synonym ]:
2-<p-Dimethylamino-phenyl>-3-methyl-4-propyl-5-ethyl-thiazoliumiodid

Chemical & Physical Properties

[ Molecular Formula ]:
C17H25IN2S

[ Molecular Weight ]:
416.36300

[ Exact Mass ]:
416.07800

[ PSA ]:
36.18000

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XJ7050166
CHEMICAL NAME :
Thiazolium, 2-(p-(dimethylamino)phenyl)-5-ethyl-3-methyl-4-propyl -, iodide
CAS REGISTRY NUMBER :
21176-91-0
LAST UPDATED :
199309
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H25-N2-S.I
MOLECULAR WEIGHT :
416.40
WISWESSER LINE NOTATION :
T5K CSJ A1 BR DN1&1& D2 E3 &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 :
1 gm/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 :
100 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

Synthetic Route

Precursor & DownStream

Precursor

  • 3-bromoheptan-4-one

DownStream


Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 7-[4-(4-acetylphenyl)piperazine-1-carbonyl]-3-(2-phenylethyl)-4a,5,6,7,8,8a-hexahydro-1H-quinazoline-2,4-dione
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide