6,7-Dimethoxy-2-methyl-1-veratryl-3(2H)-isoquinolone hydrochloride

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Names

[ Name ]:
6,7-Dimethoxy-2-methyl-1-veratryl-3(2H)-isoquinolone hydrochloride

[Synonym ]:
3(2H)-ISOQUINOLINONE,6,7-DIMETHOXY-2-METHYL-1-VERATRYL-,HYDROCHLORIDE
1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-3-oxo-2,3-dihydroisoquinolinium chloride
6,7-Dimethoxy-2-methyl-1-veratryl-3(2H)-isoquinolone hydrochloride
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-2H-isoquinolin-2-ium-3-one chloride
3(2H)-Isoquinolinone,1-((3,4-dimethoxyphenyl)methyl)-6,7-dimethoxy-2-methyl-,hydrochloride

Chemical & Physical Properties

[ Boiling Point ]:
633.5ºC at 760 mmHg

[ Molecular Formula ]:
C₂₁H₂₄ClNO₅

[ Molecular Weight ]:
405.87200

[ Flash Point ]:
336.9ºC

[ Exact Mass ]:
405.13400

[ PSA ]:
58.92000

[ LogP ]:
3.96570

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NX6037500

CHEMICAL NAME :: 3(2H)-Isoquinolinone, 6,7-dimethoxy-2-methyl-1-veratryl-, hydrochloride

CAS REGISTRY NUMBER :: 37415-52-4

LAST UPDATED :: 199309

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C21-H23-N-O5.Cl-H

MOLECULAR WEIGHT :: 405.91

WISWESSER LINE NOTATION :: T66 CNVJ B1R CO1 DO1& C1 HO1 IO1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1 gm/kg

TOXIC EFFECTS :: Brain and Coverings - recordings from specific areas of CNS Sense Organs and Special Senses (Eye) - ptosis Behavioral - somnolence (general depressed activity)

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: 15,1131,1972

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: 304 mg/kg

TOXIC EFFECTS :: Brain and Coverings - recordings from specific areas of CNS Sense Organs and Special Senses (Eye) - ptosis Behavioral - somnolence (general depressed activity)

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: 15,1131,1972

Related Compounds

(2R)-1-[3-(2-methylphenyl)phenyl]propan-2-ol
2-Chloro-1-[4-(pentafluoroethyl)phenyl]ethan-1-ol
3-Amino-3-[2-(difluoromethoxy)-3-methylphenyl]cyclobutan-1-ol
2-amino-2-(3-bromo-1-methyl-1H-pyrazol-5-yl)propan-1-ol
3-(4-Bromo-3,5-dimethylphenyl)-3-hydroxypropanenitrile
3-Amino-3-[3-(trifluoromethyl)pyridin-2-yl]cyclobutan-1-ol
2-(2-Amino-1,1-difluoropropan-2-yl)-4-chloro-6-methoxyphenol
tert-butyl N-(3-cyclohexyl-3-hydroxybutyl)carbamate
[2,2'-Bipyridin]-6(1H)-one, 5'-fluoro-
methyl 5-(2-hydroxy-2-methylpropyl)-1-methyl-1H-pyrazole-3-carboxylate

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