4-Piperidinol, 1-methyl-, 3,4,5-trimethoxybenzoate, hydrochloride

CAS 3612-12-2 MFCD N/A

化学结构图

3612-12-2
SMILES: COc1cc(C(=O)OC2CCN(C)CC2)cc(OC)c1OC.Cl

化学属性

Mol. Weight345.86
Mol. FormulaC16H23NO5.ClH

别名和识别编码

Synonym Benzoic acid, 3,4,5-trimethoxy-, 1-methyl-4-piperidinyl ester,
Wiswesser Line NotationT6NTJ A1 DOVR CO1 DO1 EO1 &GH
Chemical Name4-Piperidinol, 1-methyl-, 3,4,5-trimethoxybenzoate, hydrochloride
CAS Number3612-12-2
InChIKeySKJRZXWJRHREEE-UHFFFAOYSA-N
PubChem Substance ID199008
InChIInChI=1S/C16H23NO5.ClH/c1-17-7-5-12(6-8-17)22-16(18)11-9-13(19-2)15(21-4)14(10-11)20-3;/h9-10,12H,5-8H2,1-4H3;1H
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安全信息

RTECSTN7830000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 80 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
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: 7,319,1964

系列性分类

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