3-(p-Hydroxyphenyl)-3-methyl-1-phenethylpiperidine, oxalate

CAS 6604-27-9 MFCD06604279

化学结构图

6604-27-9
SMILES: CC1(c2cccc(O)c2)CCCN(CCc2ccccc2)C1.O=C(O)C(=O)O

化学属性

Mol. Weight385.50
Mol. FormulaC20H25NO.C2H2O4

别名和识别编码

Wiswesser Line NotationT6NTJ AY1&R& C1 CR CQ &QVVQ
Chemical NamePhenol, 3-(3-(3-methyl-1-phenethylpiperidinyl))-, oxalate
Synonym Piperidine, 3-(p-hydroxyphenyl)-3-methyl-1-phenethyl-, oxalate 3-(p-Hydroxyphenyl)-3-methyl-1-phenethylpiperidine, oxalate 3-(3-(3-Methyl-1-phenethylpiperidinyl))phenol, oxalate
CAS Number6604-27-9
InChIKeyJHIOVODYSFNQBG-UHFFFAOYSA-N
PubChem Substance ID201700
InChIInChI=1S/C20H25NO.C2H2O4/c1-20(18-9-5-10-19(22)15-18)12-6-13-21(16-20)14-11-17-7-3-2-4-8-17;3-1(4)2(5)6/h2-5,7-10,15,22H,6,11-14,16H2,1H3;(H,3,4)(H,5,6)
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安全信息

RTECSSM1137000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 208 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: 7,298,1964

系列性分类

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