(9S)-6'-methoxycinchonan-9-ol monohydrochloride

Modify Date: 2025-08-25 00:15:27

(9S)-6'-methoxycinchonan-9-ol monohydrochloride Structure
(9S)-6'-methoxycinchonan-9-ol monohydrochloride structure
Common Name (9S)-6'-methoxycinchonan-9-ol monohydrochloride
CAS Number 1668-99-1 Molecular Weight 360.87800
Density N/A Boiling Point 495.9ºC at 760mmHg
Molecular Formula C20H25ClN2O2 Melting Point N/A
MSDS N/A Flash Point 253.7ºC

 Names

Name (S)-[(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol,hydrochloride
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 495.9ºC at 760mmHg
Molecular Formula C20H25ClN2O2
Molecular Weight 360.87800
Flash Point 253.7ºC
Exact Mass 360.16000
PSA 45.59000
LogP 3.91310
Vapour Pressure 1.19E-10mmHg at 25°C
InChIKey LBSFSRMTJJPTCW-VJAUXQICSA-N
SMILES C=CC1CN2CCC1CC2C(O)c1ccnc2ccc(OC)cc12.Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VA5750000
CHEMICAL NAME :
Quinidine, monohydrochloride
CAS REGISTRY NUMBER :
1668-99-1
LAST UPDATED :
199506
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C20-H24-N2-O2.Cl-H

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
263 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 27,589,1977
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 52,2797,1992
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
30 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 27,589,1977
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>125 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 52,2797,1992 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
600 mg/kg/4D-I
TOXIC EFFECTS :
Kidney, Ureter, Bladder - other changes Blood - changes in serum composition (e.g. TP, bilirubin, cholesterol)
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 33,203,1995

 Synonyms

Quinidine,monohydrochloride
EINECS 216-792-8
Chinidin hydrochlorid
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