1,4-Naphthalenedione, 2-[[3- (4-methyl-1-piperazinyl)propyl]amino]-

Modify Date: 2025-09-12 16:03:55

1,4-Naphthalenedione, 2-[[3- (4-methyl-1-piperazinyl)propyl]amino]- structure	Common Name	1,4-Naphthalenedione, 2-[[3- (4-methyl-1-piperazinyl)propyl]amino]-
	CAS Number	38528-40-4	Molecular Weight	313.39400
	Density	1.22g/cm3	Boiling Point	489.2ºC at 760 mmHg
	Molecular Formula	C₁₈H₂₃N₃O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	249.6ºC

Name	2-[3-(4-methylpiperazin-1-yl)propylamino]naphthalene-1,4-dione

Density	1.22g/cm3
Boiling Point	489.2ºC at 760 mmHg
Molecular Formula	C₁₈H₂₃N₃O₂
Molecular Weight	313.39400
Flash Point	249.6ºC
Exact Mass	313.17900
PSA	52.65000
LogP	1.44330
Index of Refraction	1.615
InChIKey	XVOWQUMVQNCAGK-UHFFFAOYSA-N
SMILES	CN1CCN(CCCNC2=CC(=O)c3ccccc3C2=O)CC1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QL9277000

CHEMICAL NAME :: 1,4-Naphthoquinone, 2-(3-(4-methyl-1-piperazinyl)propylamino)-

CAS REGISTRY NUMBER :: 38528-40-4

BEILSTEIN REFERENCE NO. :: 0809127

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H23-N3-O2

MOLECULAR WEIGHT :: 313.44

WISWESSER LINE NOTATION :: L66 BV EVJ CM3- AT6N DNTJ D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 320 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: 15,504,1972

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Product Name: 1,4-Naphthalenedione, 2-[[3- (4-methyl-1-piperazinyl)propyl]amino]-
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