3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Modify Date: 2025-10-30 07:15:33

3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium Structure
3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium structure
 Common Name 3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium
CAS Number 63937-54-2 Molecular Weight 588.62600
Density N/A Boiling Point 501.9ºC at 760 mmHg
Molecular Formula C28H32N2O10S Melting Point N/A
MSDS N/A Flash Point 257.3ºC

 Names

Name 3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium

 Chemical & Physical Properties

Boiling Point 501.9ºC at 760 mmHg
Molecular Formula C28H32N2O10S
Molecular Weight 588.62600
Flash Point 257.3ºC
Exact Mass 588.17800
PSA 187.80000
LogP 5.89880

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NX5020000
CHEMICAL NAME :
Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-(alpha-me thyl-4-nitro)phenethy l-, hydrogen sulfosalicylate
CAS REGISTRY NUMBER :
63937-54-2
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H26-N2-O4.C7-H6-O6
MOLECULAR WEIGHT :
556.62

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
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: 5,292,1965
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Chemsrc provides CAS#:63937-54-2 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium>> amp version: 3-carboxy-4-hydroxybenzenesulfonate,6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium

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