Quinolinium,6-amino-1-methyl-4-[[4-[[[4-[(1-methylpyridinium-4-yl)amino]phenyl]amino]carbonyl]phenyl]amino]-,bromide (1:2)

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Names

[ Name ]:
Quinolinium,6-amino-1-methyl-4-[[4-[[[4-[(1-methylpyridinium-4-yl)amino]phenyl]amino]carbonyl]phenyl]amino]-,bromide (1:2)

[Synonym ]:
Quinolinium dibromide
Cain's quinolinium

Chemical & Physical Properties

[ Molecular Formula ]:
C₂₉H₂₈BrN₆O+

[ Molecular Weight ]:
556.47600

[ Exact Mass ]:
555.15100

[ PSA ]:
86.94000

[ LogP ]:
2.61470

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: VC3530450

CHEMICAL NAME :: Quinolinium, 6-amino-1-methyl-4-((4-((((1-methylpyridinium-4-yl)am ino)phenyl)carbamoyl) phenyl)amino)-, dibromide

CAS REGISTRY NUMBER :: 50308-94-6

LAST UPDATED :: 199409

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C29-H28-N6-O.2Br

MOLECULAR WEIGHT :: 636.45

WISWESSER LINE NOTATION :: T66 BKJ B1 HZ EMR DVMR DM- DT6KJ A1 &E 2

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 :: 7399 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 35910 ug/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :: DNA adduct

TEST SYSTEM :: Mammal - species unspecified Lymphocyte

DOSE/DURATION :: 67 mg/L

REFERENCE :: PHMGBN Pharmacology: International Journal of Experimental and Clinical Pharmacology. (S. Karger AG, Postfach CH-4009 Basel, Switzerland) V.1- 1968- Volume(issue)/page/year: 17,61,1978

Safety Information

[ HS Code ]:
2933499090

Customs

[ HS Code ]: 2933499090

[ Summary ]:
2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

(1S)-1-(2-bromo-4,5-dimethoxyphenyl)ethan-1-ol
(1S)-1-{1H-pyrrolo[2,3-b]pyridin-3-yl}ethan-1-ol
(1s)-1-(2-Chloro-4-methoxyphenyl)ethan-1-ol
1-Tosyl-1H-pyrrole-3-sulfonyl chloride
2-(Trifluoromethyl)pyridine-3-carbothioamide
Cyclopropyl-(2-methyl-5-nitrobenzyl)-amine
3-Amino-4-phenylpentan-1-ol
[2-(Trifluoromethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
2-[2-(Pyridazin-4-YL)-1,3-thiazol-4-YL]ethan-1-amine
2-(3-Propan-2-ylpiperazin-1-yl)pyrimidine

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