Acetophenone, 2-nitrilo-3',4',5'-trimethoxy-

CAS 5955-75-9 MFCD05955759

化学结构图

5955-75-9
SMILES: COc1cc(C(=O)C#N)cc(OC)c1OC

化学属性

Mol. FormulaC11H11NO4
Mol. Weight221.23

别名和识别编码

Wiswesser Line NotationNCVR CO1 DO1 EO1
Chemical NameAcetophenone, 2-nitrilo-3',4',5'-trimethoxy-
Synonym 2-Nitrilo-3',4',5'-trimethoxyacetophenone
CAS Number5955-75-9
Beilstein Registry Number2699129
InChIKeyNHZLVOHMHLFZLS-UHFFFAOYSA-N
PubChem Substance ID22239
InChIInChI=1S/C11H11NO4/c1-14-9-4-7(8(13)6-12)5-10(15-2)11(9)16-3/h4-5H,1-3H3
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安全信息

RTECSAM9550000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 65 mg/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 7,178,1964

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