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CAS No.: | 513-10-0 |
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Name: | ECOTHIOPATE IODIDE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C9H23 N O3 P S . I |
Molecular Weight: | 383.231 |
Synonyms: | (2-Mercaptoethyl)trimethylammoniumiodide, O,O-diethyl phosphorothioate (6CI); (2-Mercaptoethyl)trimethylammoniumiodide, S-ester with O,O-diethyl phosphorothioate (7CI); Ammonium,(2-mercaptoethyl)trimethyl-, iodide, S-ester with O,O-diethyl phosphorothioate(8CI); Ethanaminium, 2-[(diethoxyphosphinyl)thio]-N,N,N-trimethyl-, iodide (9CI);217MI; Diethoxyphosphinylthiocholine iodide; Diethylphosphorylthiocholineiodide; Echothiopate iodide; Echothiophate iodide; Ecostigmini jodidum;Ecothiopate iodide; N-[2-(Diethoxyphosphinylthio)ethyl]trimethylammoniumiodide; Phospholine iodide; S-(2-Dimethylaminoethyl)O,O-diethylphosphorothioate methiodide; S-(Diethyl phosphono)thiocholine iodide |
Melting Point: | 138° (Tammelin); mp 124-124.5° (Fitch) |
Safety: | Poison by intraperitoneal, subcutaneous, and ocular routes. When heated to decomposition it emits very toxic fumes of NOx, POx, SOx, NH3, and I−. See also IODIDES and MERCAPTANS. |
PSA: | 70.64000 |
LogP: | -0.38910 |
MF: C9H23INO3PS
MW: 383.227
EINECS: 208-152-1
Melting Point: 124–124.5°C
Atmospheric OH Rate Constant: 7.67E-11 cm3/molecule-sec
IUPAC Name: 2-Diethoxyphosphorylsulfanylethyl(trimethyl)azanium iodide
Solubility of S-(2-(N,N,N-trimethylammonio)ethyl)-O,O-diethylphosphorothiolate iodide (513-10-0): Dissolved in water
Synonyms: Ecothiopate iodide ; 2-(diethoxyphosphinylthio)ethyltrimethylammonium iodide ; Ecothiopate ; Ecostigmine ; Ecothiopate ; Phospholineiodide ; 2-[(Diethoxyphosphinyl)thio]ethanaminium
Following is the molecular structure of S-(2-(N,N,N-trimethylammonio)ethyl)-O,O-diethylphosphorothiolate iodide (513-10-0):
1. | ipr-mus LD50:140 µg/kg | TXAPA9 Toxicology and Applied Pharmacology. 6 (1964),269. | ||
2. | scu-mus LD50:130 µg/kg | JMCMAR Journal of Medicinal Chemistry. 19 (1976),810. | ||
3. | ocu-rbt LD50:250 µg/kg | AJOPAA American Journal of Ophthalmology. 53 (1962),512. |
Poison by intraperitoneal, subcutaneous, and ocular routes. When heated to decomposition it emits very toxic fumes of NOx, POx, SOx, NH3, and I−.
Safety Information of S-(2-(N,N,N-trimethylammonio)ethyl)-O,O-diethylphosphorothiolate iodide (513-10-0):
RIDADR: 3249
HazardClass 6.1(a)
PackingGroup: II