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6577-41-9

Basic Information
CAS No.: 6577-41-9
Name: Oxapium iodide
Molecular Structure:
Molecular Structure of 6577-41-9 (Oxapium iodide)
Formula: C22H34NO2
Molecular Weight: 471.422
Synonyms: 1-[(2-Cyclohexyl-2-phenyl-1,3-dioxolan-4-yl)methyl]-1-methylpiperidiniumiodide (7CI);Piperidinium,1-[(2-cyclohexyl-2-phenyl-1,3-dioxolan-4-yl)methyl]-1-methyl-, iodide(8CI,9CI);1-(2-Phenyl-2-cyclohexyl-1,3-dioxolan-4-ylmethyl)-1-methylpiperidinium iodide;ANC 113;Ciclonium iodide;Cyclonium iodide;Esperan;Oxapium iodide;SH 100;
Safety: Poison by subcutaneous, intravenous, and intraperitoneal routes. Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx and I.
PSA: 18.46000
LogP: 1.42840
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Chemistry

IUPAC Name: 1-[(2-Cyclohexyl-2-phenyl-1,3-dioxolan-4-yl)methyl]-1-methylpiperidin-1-ium iodide
Synonyms of of Oxapii iodidum (CAS NO.6577-41-9): Cyclonium ; Oxapium iodide [INN:JAN] ; 1-((2-Cyclohexyl-2-phenyl-1,3-dioxolan-4-yl)methyl)-1-methylpiperidinium iodide ; 2-Cyclohexyl-2-phenyl-4-piperidinomethyl-dioxolane-1,3 methiodide ; ANC 113 ; Ciclonium iodide ; Cyclonium iodide ; Esperan ; Iodure d'oxapium ; Iodure d'oxapium [INN-French] ; Ioduro de oxapio ; Ioduro de oxapio [INN-Spanish] ; N-Methyl-N-(2-cyclohexyl-2-phenyl-1,3 dioxolan-4-yl-methyl)-piperidinium iodide  ; Oxapii iodidum [INN-Latin] ; SH 100 ; UNII-682380CG4N ; Piperidinium, 1-((2-cyclohexyl-2-phenyl-1,3-dioxolan-4-yl)methyl)-1-methyl-, iodide
CAS NO: 6577-41-9
Classification Code: Drug / Therapeutic Agent ; Reproductive Effect
Molecular Formula: C22H34NO2
Molecular Weight: 344.5103
Molecular Structure:

H bond acceptors: 3 
Freely Rotating Bonds: 4
Polar Surface Area of Oxapii iodidum (CAS NO.6577-41-9): 18.46 Å2

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 31mg/kg (31mg/kg)   Drugs in Japan Vol. 6, Pg. 864, 1982.
mouse LD50 intraperitoneal 16mg/kg (16mg/kg) AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC Polish Journal of Pharmacology and Pharmacy. Vol. 30, Pg. 493, 1978.
mouse LD50 intravenous 6970ug/kg (6.97mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 13, Pg. 78, 1971.
mouse LD50 oral 500mg/kg (500mg/kg)   United States Patent Document. Vol. #4457931,
mouse LD50 subcutaneous 86mg/kg (86mg/kg)   United States Patent Document. Vol. #4457931,
rat LD50 intravenous 13900ug/kg (13.9mg/kg)   Drugs in Japan Vol. 6, Pg. 864, 1982.
rat LD50 oral 494mg/kg (494mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 4, Pg. 109, 1970.
rat LD50 subcutaneous 244mg/kg (244mg/kg)   Drugs in Japan Vol. 6, Pg. 864, 1982.

Safety Profile

Poison by subcutaneous, intravenous, and intraperitoneal routes. Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of NOx and I.

Standards and Recommendations

Loss on drying:  0.5%
ASH:  Less than 0.2%
Heavy Metals:  Less than 20ppm
Purity of Oxapii iodidum (CAS NO.6577-41-9):  98.5%min

Specification

Storage of Oxapii iodidum (CAS NO.6577-41-9): Keeped in well-closed place
Packing of: 1Kg/aluminium barrel,5Kg/aluminium barrel