(4-(2,5-Dimethoxyphenyl)-4-hydroxy-4-phenyl-2-butyl)trimethylammonium iodide

CAS 1099-73-6 MFCD N/A

化学结构图

1099-73-6
SMILES: COc1ccc(OC)c(C(O)(CC(C)[N+](C)(C)C)c2ccccc2)c1.[I-]

化学属性

Mol. Weight470.41
Mol. FormulaC21H29NO3.I

别名和识别编码

Wiswesser Line Notation1OR DO1 BXQR&1Y1&K1&1&1 &I
Chemical NameYS 3643
Synonym (4-(2,5-Dimethoxyphenyl)-4-hydroxy-4-phenyl-2-butyl)trimethylammonium
CAS Number1099-73-6
InChIKeyBIMKPYYUQXWQKN-UHFFFAOYSA-M
PubChem Substance ID14191
InChIInChI=1S/C21H30NO3.HI/c1-16(22(2,3)4)15-21(23,17-10-8-7-9-11-17)19-14-18(24-5)12-13-20(19)25-6;/h7-14,16,23H,15H2,1-6H3;1H/q+1;/p-1
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安全信息

RTECSBP9050000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 78 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 15,1279,1965

系列性分类

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