sodium 1-amino-9,10-dihydro-4-[[3-[[(2-hydroxyethyl)amino]sulphonyl]-4-methylphenyl]amino]-9,10-dioxoanthracene-2-sulphonate

Modify Date: 2024-09-19 09:32:25

sodium 1-amino-9,10-dihydro-4-[[3-[[(2-hydroxyethyl)amino]sulphonyl]-4-methylphenyl]amino]-9,10-dioxoanthracene-2-sulphonate structure	Common Name	sodium 1-amino-9,10-dihydro-4-[[3-[[(2-hydroxyethyl)amino]sulphonyl]-4-methylphenyl]amino]-9,10-dioxoanthracene-2-sulphonate
	CAS Number	40847-64-1	Molecular Weight	553.54000
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₃H₂₀N₃NaO₈S₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	sodium,1-amino-4-[3-(2-hydroxyethylsulfamoyl)-4-methylanilino]-9,10-dioxoanthracene-2-sulfonate

Molecular Formula	C₂₃H₂₀N₃NaO₈S₂
Molecular Weight	553.54000
Exact Mass	553.05900
PSA	212.55000
LogP	4.47760
InChIKey	KGFQWQPBSFDQQE-UHFFFAOYSA-M
SMILES	Cc1ccc(Nc2cc(S(=O)(=O)[O-])c(N)c3c2C(=O)c2ccccc2C3=O)cc1S(=O)(=O)NCCO.[Na+]

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CB1095000

CHEMICAL NAME :: 2-Anthracenesulfonic acid, 9,10-dihydro-1-amino-4-(3-(2-hydroxyethyl)aminosulfon yl-4- methylphenylamino)-9,10-dioxo-, sodium salt

CAS REGISTRY NUMBER :: 40847-64-1

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C23-H20-N3-O8-S2.Na

MOLECULAR WEIGHT :: 553.57

WISWESSER LINE NOTATION :: L C666 BV IVJ DZ ESWO GMR D1 CSWM2Q &-NA-

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration into the eye

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: 28ZPAK "Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku," Marhold, J.V., Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha, Czechoslovakia, 1972 Volume(issue)/page/year: -,241,1972

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