Diethyl(4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenyl-2-butyl)methylammonium iodide

CAS 858-57-1 MFCD N/A

化学结构图

858-57-1
SMILES: CC[N+](CC)(CC)C(C)CC(O)(c1ccccc1)c1cc(OC)ccc1OC.[I-]

化学属性

Mol. Weight498.47
Mol. FormulaC23H33NO3.I

别名和识别编码

Wiswesser Line Notation2K2&1&Y1&1XQR&R BO1 EO1 &I
Chemical NameYS 3645
Synonym Diethyl(4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenyl-2-butyl)methylammonium
CAS Number858-57-1
InChIKeySKMHSCACSAEPRD-UHFFFAOYSA-M
PubChem Substance ID120817
InChIInChI=1S/C24H36NO3.HI/c1-7-25(8-2,9-3)19(4)18-24(26,20-13-11-10-12-14-20)22-17-21(27-5)15-16-23(22)28-6;/h10-17,19,26H,7-9,18H2,1-6H3;1H/q+1;/p-1
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安全信息

RTECSBP7020000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 213 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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