1-Ethyl-4-(N-ethyl-2-phenylethylamino)butyl-3,4,5-trimethoxybenzoate hydrochloride

Modify Date: 2025-09-14 08:52:24

1-Ethyl-4-(N-ethyl-2-phenylethylamino)butyl-3,4,5-trimethoxybenzoate hydrochloride structure	Common Name	1-Ethyl-4-(N-ethyl-2-phenylethylamino)butyl-3,4,5-trimethoxybenzoate hydrochloride
	CAS Number	60491-27-2	Molecular Weight	480.03700
	Density	1.065g/cm3	Boiling Point	524.8ºC at 760 mmHg
	Molecular Formula	C₂₆H₃₈ClNO₅	Melting Point	N/A
	MSDS	N/A	Flash Point	271.2ºC

Name	6-[ethyl(2-phenylethyl)amino]hexan-3-yl 3,4,5-trimethoxybenzoate,hydrochloride

Density	1.065g/cm3
Boiling Point	524.8ºC at 760 mmHg
Molecular Formula	C₂₆H₃₈ClNO₅
Molecular Weight	480.03700
Flash Point	271.2ºC
Exact Mass	479.24400
PSA	57.23000
LogP	5.79460
Index of Refraction	1.526
InChIKey	MWKGTERQJQSUGB-UHFFFAOYSA-N
SMILES	CCC(CCC[NH+](CC)CCc1ccccc1)OC(=O)c1cc(OC)c(OC)c(OC)c1.[Cl-]

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DI0525000

CHEMICAL NAME :: Benzoic acid, 3,4,5-trimethoxy-, 1'-ethyl-4'-(N-ethyl-N-phenethylamino)butyl ester, hydrochloride

CAS REGISTRY NUMBER :: 60491-27-2

LAST UPDATED :: 199012

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C26-H37-N-O5.Cl-H

MOLECULAR WEIGHT :: 480.10

WISWESSER LINE NOTATION :: 1OR BO1 CO1 EVOY2&3N2&2R &GH

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 :: 130 mg/kg

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

REFERENCE :: 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,338,1972

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