5-Norbornene-2,3-dicarboximide, N-ethyl-5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-, endo-and ethyl acetate (2:1)

CAS 5834-47-9 MFCD N/A

化学结构图

5834-47-9
SMILES: CCN1C(=O)C2C3C=C(C(O)(c4ccccc4)c4ccccn4)C(C3=C(c3ccccc3)c3ccccn3)C2C1=O.CCN1C(=O)C2C3C=C(C(O)(c4ccccc4)c4ccccn4)C(C3=C(c3ccccc3)c3ccccn3)C2C1=O.CCOC(C)=O

化学属性

Mol. Weight1167.46
Mol. FormulaC70H58N6O6.C4H8O2

别名和识别编码

Wiswesser Line NotationT C555 A AY DVNV IUTJ E2 AUYR&- BT6NJ& IXQR&- BT6NJ&2OV1
Chemical Name5-Norbornene-2,3-dicarboximide, N-ethyl-5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-, endo- and ethyl acetate (2:1)
CAS Number5834-47-9
InChIKeyGDRTZMGPBFMJEG-JODUUXMTSA-N
PubChem Substance ID11979887
InChIInChI=1S/2C35H29N3O3.C4H8O2/c2*1-2-38-33(39)30-24-21-25(35(41,23-15-7-4-8-16-23)27-18-10-12-20-37-27)31(32(30)34(38)40)29(24)28(22-13-5-3-6-14-22)26-17-9-11-19-36-26;1-3-6-4(2)5/h2*3-21,24,30-32,41H,2H2,1H3;3H2,1-2H3/b2*29-28-;
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安全信息

RTECSRB8600000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 7500 ug/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: 9,537,1966

系列性分类

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