4-(3,4-dimethyl-5-octyl-1,3-thiazol-3-ium-2-yl)-N,N-dimethylaniline,iodide
Names
[ CAS No. ]:
21176-92-1
[ 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