3-benzyl-1,2-dimethyl-5-(trifluoromethyl)benzimidazol-1-ium,bromide

Names

[ CAS No. ]:
68772-49-6

[ Name ]:
3-benzyl-1,2-dimethyl-5-(trifluoromethyl)benzimidazol-1-ium,bromide

[Synonym ]:
EINECS 268-055-5
3-Benzyl-1,2-dimethyl-5-trifluoromethylbenzimidazolium bromide

Chemical & Physical Properties

[ Molecular Formula ]:
C17H16BrF3N2

[ Molecular Weight ]:
385.22200

[ Exact Mass ]:
384.04500

[ PSA ]:
8.81000

[ LogP ]:
0.84530

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UU6857400
CHEMICAL NAME :
Pyridinium, 1,1'-(p-phenylenebis(vinylene-p-phenylene))bis-, di-p-toluenesulfonate
CAS REGISTRY NUMBER :
68772-49-6
LAST UPDATED :
199409
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C29-H26-N2.2C7-H7-O3-S
MOLECULAR WEIGHT :
744.97
WISWESSER LINE NOTATION :
T6KJ AR D1U1R D1U1R D- AT6KJ &WSO&R D1 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
7 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
DNA adduct
TEST SYSTEM :
Rodent - mouse Lymphocyte
DOSE/DURATION :
760 nmol/L
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: 22,134,1979

Related Compounds

  • 2-((4-(2-Methylpiperidin-1-yl)-1,2,5-thiadiazol-3-yl)oxy)acetic acid
  • 3-(trifluoromethyl)-2,5-dihydro-1H-pyrrole
  • 2-((4-(3,5-Dimethylpiperidin-1-yl)-1,2,5-thiadiazol-3-yl)oxy)acetic acid
  • 2-Amino-5-[[1-(4-pyridinyl)ethyl]amino]benzoic acid
  • 5-Oxo-2-(p-tolyl)tetrahydrofuran-3-carboxylic acid
  • 4-Chloro-1-(2-methyl-propenyl)-2-trifluoromethyl-benzene
  • 2-(4-(tert-Butyl)phenyl)-5-oxotetrahydrofuran-3-carboxylic acid
  • 1-Benzyl-4-bromo-azepan-3-one
  • 2-(2-Ethoxyphenyl)-5-oxotetrahydrofuran-3-carboxylic acid
  • N-(2,4-dimethylcyclohexyl)prop-2-enamide
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