6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium,chloride

Names

[ CAS No. ]:
63938-07-8

[ Name ]:
6,7-dimethoxy-1-[2-(4-nitrophenyl)ethyl]-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium,chloride

Chemical & Physical Properties

[ Boiling Point ]:
516.8ºC at 760mmHg

[ Molecular Formula ]:
C₂₂H₂₇ClN₂O₄

[ Molecular Weight ]:
418.91400

[ Flash Point ]:
266.3ºC

[ Exact Mass ]:
418.16600

[ PSA ]:
67.52000

[ LogP ]:
5.59310

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NX4910000

CHEMICAL NAME :: Isoquinoline, 1,2,3,4-tetrahydro-2-allyl-6,7-dimethoxy-1-(4-nitroph enethyl)-, hydrochloride

CAS REGISTRY NUMBER :: 63938-07-8

LAST UPDATED :: 199012

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C22-H26-N2-O4.Cl-H

MOLECULAR WEIGHT :: 418.96

WISWESSER LINE NOTATION :: T66 CNT&J B2R DNW& C2U1 HO1 JO1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 70 mg/kg

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

REFERENCE :: MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 5,293,1965

Related Compounds

4,5-Dimethylpyridine-2,3-diamine
(r)-4-(1-Amino-2-hydroxyethyl)-3-methoxyphenol
(R)-2-(2-Bromo-4-methylphenyl)pyrrolidine
5-Benzothiazolecarbonyl chloride
1-Ethyl-3-(3-methoxyphenyl)piperazine
3-Amino-5-bromo-2-iodobenzoic acid
Ethyl 3-amino-5-carbamoylbenzoate
2-(4-(hydroxymethyl)-1H-imidazol-1-yl)-5-(2-oxopyridin-1(2H)-yl)benzoic acid
Methyl 3-amino-4-fluoro-5-nitrobenzoate
Methyl 2-amino-3-fluoro-5-methylbenzoate

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