Pyrimidinium, 4, 4-[terephthaloylbis(imino-p-phenyleneimino)]bis-(2-amino-1-ethyl- , di-p-toluenesulfonate, hemihydrate

Modify Date: 2025-09-18 20:18:57

Pyrimidinium, 4, 4-[terephthaloylbis(imino-p-phenyleneimino)]bis-(2-amino-1-ethyl- , di-p-toluenesulfonate, hemihydrate structure	Common Name	Pyrimidinium, 4, 4-[terephthaloylbis(imino-p-phenyleneimino)]bis-(2-amino-1-ethyl- , di-p-toluenesulfonate, hemihydrate
	CAS Number	20719-29-3	Molecular Weight	761.87200
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₃₉H₄₁N₁₀O₅S+	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	Pyrimidinium, 4,4'-[terephthaloylbis(imino-p-phenyleneimino)]bis-(2-amino-1-ethyl-, di-p-toluenesulfonate, hemihydrate

Molecular Formula	C₃₉H₄₁N₁₀O₅S+
Molecular Weight	761.87200
Exact Mass	761.29800
PSA	233.42000
LogP	7.68190

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UW5976720

CHEMICAL NAME :: Pyrimidinium, 4,4'-(terephthaloylbis(imino-p-phenyleneimino))bis(2- amino-1-ethyl-, di-p- toluenesulfonate

CAS REGISTRY NUMBER :: 20719-29-3

LAST UPDATED :: 199409

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C32-H34-N10-O2.2C7-H7-O3-S

MOLECULAR WEIGHT :: 933.16

WISWESSER LINE NOTATION :: T6K CNJ A2 BZ F1 DMR DMVR DVMR DM- DT6K CNJ A2 BZ F1 &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 :: 112 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 :: 450 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

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