Butyronitrile, 2-phenyl-2-(2-piperidinoethyl)-3-methyl-

CAS 2809-50-9 MFCD01737463

化学结构图

2809-50-9
SMILES: CC(C)C(C#N)(CCN1CCCCC1)c1ccccc1

化学属性

Mol. FormulaC18H26N2
Mol. Weight270.46

别名和识别编码

Chemical NameButyronitrile, 2-phenyl-2-(2-piperidinoethyl)-3-methyl-
Wiswesser Line NotationT6NTJ A2XR&CN&Y1&1
Synonym 2-Phenyl-2-(2-piperidinoethyl)-3-methylbutyronitrile
CAS Number2809-50-9
Beilstein Registry Number1348599
InChIKeyHEKDUNZUGUQWGW-UHFFFAOYSA-N
PubChem Substance ID17764
InChIInChI=1S/C18H26N2/c1-16(2)18(15-19,17-9-5-3-6-10-17)11-14-20-12-7-4-8-13-20/h3,5-6,9-10,16H,4,7-8,11-14H2,1-2H3
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安全信息

RTECSEU0670000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 70 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: 8,589,1965

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