1-(2,6-Bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy)phenyl)ethanone tetrahydrochloride

Modify Date: 2025-11-26 18:20:02

1-(2,6-Bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy)phenyl)ethanone tetrahydrochloride structure	Common Name	1-(2,6-Bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy)phenyl)ethanone tetrahydrochloride
	CAS Number	87049-21-6	Molecular Weight	501.05900
	Density	1.161g/cm3	Boiling Point	626.9ºC at 760 mmHg
	Molecular Formula	C₂₄H₄₁ClN₄O₅	Melting Point	N/A
	MSDS	N/A	Flash Point	332.9ºC

Name	1-[2,6-bis[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]ethanone,hydrochloride

Density	1.161g/cm3
Boiling Point	626.9ºC at 760 mmHg
Molecular Formula	C₂₄H₄₁ClN₄O₅
Molecular Weight	501.05900
Flash Point	332.9ºC
Exact Mass	500.27700
PSA	88.95000
LogP	0.41700
Index of Refraction	1.551
InChIKey	FJSWWSUQGOOLAJ-UHFFFAOYSA-N
SMILES	CC(=O)c1c(OCC(O)CN2CCN(C)CC2)cccc1OCC(O)CN1CCN(C)CC1.Cl

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KM5547775

CHEMICAL NAME :: Ethanone, 1-(2,6-bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propox y)phenyl)-, tetrahydrochloride

CAS REGISTRY NUMBER :: 87049-21-6

LAST UPDATED :: 198709

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C24-H40-N4-O5.4Cl-H

MOLECULAR WEIGHT :: 610.52

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 :: 38300 ug/kg

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

REFERENCE :: IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 22,140,1983

methylpiperazine

CAS#:109-01-3

2,6-bis(2,3-epo...

CAS#:87048-92-8

~88%

1-(2,6-Bis(2-hy...

CAS#:87049-21-6

Literature: Malik, Mangel S.; Rastogi, Shri Nivas; Srimal, R. C.; Kar, K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1983 , vol. 22, # 2 p. 140 - 145

2,6-Dihydroxyac...

CAS#:699-83-2

1-(2,6-Bis(2-hy...

CAS#:87049-21-6

Literature: Malik, Mangel S.; Rastogi, Shri Nivas; Srimal, R. C.; Kar, K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1983 , vol. 22, # 2 p. 140 - 145

Precursor 3
CAS#:109-01-3 methylpiperazine CAS#:87048-92-8 2,6-bis(2,3-epo... CAS#:699-83-2 2,6-Dihydroxyac...
DownStream 0

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1-(2,6-Bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy)phenyl)ethanone tetrahydrochloride

Names

Chemical & Physical Properties

Toxicological Information