4,6-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-, hexanedioate, hydrate (4:2:1)

Modify Date: 2025-09-24 20:41:52

4,6-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-, hexanedioate, hydrate (4:2:1) Structure
4,6-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-, hexanedioate, hydrate (4:2:1) structure
 Common Name 4,6-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-, hexanedioate, hydrate (4:2:1)
CAS Number 79677-09-1 Molecular Weight 433.45200
Density N/A Boiling Point 539ºC at 760 mmHg
Molecular Formula C22H27NO8 Melting Point N/A
MSDS N/A Flash Point 279.8ºC

 Names

Name 1-(4-hydroxy-3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol,6-hydroxy-6-oxohexanoate
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 539ºC at 760 mmHg
Molecular Formula C22H27NO8
Molecular Weight 433.45200
Flash Point 279.8ºC
Exact Mass 433.17400
PSA 156.55000
LogP 2.87720

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NX0484100
CAS REGISTRY NUMBER :
79677-09-1
LAST UPDATED :
198706
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H17-N-O4.1/2C6-H10-O4.1/4H2-O
MOLECULAR WEIGHT :
364.89

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 :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 18,262,1984

 Synonyms

4,6-Isoquinolinediol,1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-,hexanedioate,hydrate (4:2:1)
1-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-1H-isoquinolin-2-ium-4,6-diol
1,2,3,4-Tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-4,6-isoquinolinediol hexanedioate H2O (4:2:1)
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Chemsrc provides CAS#:79677-09-1 MSDS, density, melting point, boiling point, structure, etc. Its name is 4,6-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-, hexanedioate, hydrate (4:2:1)>> amp version: 4,6-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-hydroxy-3-methoxyphenyl)-, hexanedioate, hydrate (4:2:1)

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