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26106-21-8

26106-21-8 structure

26106-21-8 structure

Name: 3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium,chloride
Chemical Name: 3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium,chloride
CAS Number: 26106-21-8
Molecular Formula: C₁₇H₂₆ClNO₂S
Molecular Weight: 343.91200
Create Date: 2016-02-03 15:55:35
Modify Date: 2024-01-31 22:45:04

Name	3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium,chloride
Synonyms	LU 5-046 hydrochloride 3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium chloride Benzo(c)thiophene-1-carboxylic acid,1,3-dihydro-3,3-dimethyl-1-(3-(dimethylamino)propyl)-,methyl ester,hydrochloride

Boiling Point	392.1ºC at 760mmHg
Molecular Formula	C₁₇H₂₆ClNO₂S
Molecular Weight	343.91200
Flash Point	190.9ºC
Exact Mass	343.13700
PSA	54.84000
LogP	4.18060
Vapour Pressure	2.35E-06mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DL9602000

CHEMICAL NAME :: Benzo(c)thiophene-1-carboxylic acid, 1,3-dihydro-3,3-dimethyl-1-(3-(dimethylamino)propyl)- , methyl ester, hydrochloride

CAS REGISTRY NUMBER :: 26106-21-8

LAST UPDATED :: 198506

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C17-H25-N-O2-S.Cl-H

MOLECULAR WEIGHT :: 343.95

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 50 mg/kg

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

REFERENCE :: APTOA6 Acta Pharmacologica et Toxicologica. (Copenhagen, Denmark) V.1-59, 1945-86. For publisher information, see PHTOEH Volume(issue)/page/year: 28,241,1970

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 23 mg/kg

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

REFERENCE :: APTOA6 Acta Pharmacologica et Toxicologica. (Copenhagen, Denmark) V.1-59, 1945-86. For publisher information, see PHTOEH Volume(issue)/page/year: 28,241,1970