beta-Methyl-alpha-phenyl-alpha-p-tolyl-1-pyrrolidinepropanol

CAS 4150-96-3 MFCD N/A

化学结构图

4150-96-3
SMILES: Cc1ccc(C(O)(c2ccccc2)C(C)CN2CCCC2)cc1

化学属性

Mol. Weight309.49
Mol. FormulaC21H27NO

别名和识别编码

Wiswesser Line NotationT5NTJ A1Y1&XQR&R D1
Chemical Name1-Pyrrolidinepropanol, beta-methyl-alpha-phenyl-alpha-p-tolyl-
Synonym beta-Methyl-alpha-phenyl-alpha-p-tolyl-1-pyrrolidinepropanol
Beilstein Registry Number1434232
CAS Number4150-96-3
InChIKeyKRTKWNFZWIMZGF-UHFFFAOYSA-N
PubChem Substance ID199419
InChIInChI=1S/C21H27NO/c1-17-10-12-20(13-11-17)21(23,19-8-4-3-5-9-19)18(2)16-22-14-6-7-15-22/h3-5,8-13,18,23H,6-7,14-16H2,1-2H3
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安全信息

RTECSUY2262600 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 250 mg/kg
TOXIC EFFECTS :
   Kidney, Ureter, Bladder - urine volume increased
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: 8,836,1965

系列性分类

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