2-Pyrrolidinone, 3-dimethylamino-1-phenyl-, picrate

CAS 6122-46-9 MFCD06122469

化学结构图

6122-46-9
SMILES: CN(C)[C@H]1CCN(c2ccccc2)C1=O.O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1

化学属性

Mol. Weight433.42
Mol. FormulaC12H16N2O.C6H3N3O7

别名和识别编码

Wiswesser Line NotationT5NVTJ AR& CN1&1 &WNR BQ CNW ENW
Chemical Name2-Pyrrolidinone, 3-dimethylamino-1-phenyl-, picrate
Synonym 3-Dimethylamino-1-phenyl-2-pyrrolidinone picrate
CAS Number6122-46-9
InChIKeyKRAQAOBRFYZSEU-UHFFFAOYSA-N
PubChem Substance ID110781
InChIInChI=1S/C12H16N2O.C6H3N3O7/c1-13(2)11-8-9-14(12(11)15)10-6-4-3-5-7-10;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-7,11H,8-9H2,1-2H3;1-2,10H
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安全信息

RTECSUY5763000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 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: 9,315,1966

系列性分类

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