5-Norbornene-2,3-dicarboximide, N-butyl-5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-, endo-

CAS 4634-46-2 MFCD04634462

化学结构图

4634-46-2
SMILES: CCCCN1C(=O)C2C3C=C(C(O)(c4ccccc4)c4ccccn4)C(C3=C(c3ccccc3)c3ccccn3)C2C1=O

化学属性

Mol. Weight567.73
Mol. FormulaC37H33N3O3

别名和识别编码

Wiswesser Line NotationT C555 A AY DVNV IUTJ E4 AUYR&- BT6NJ& IXQR&- BT6NJ
Chemical Name5-Norbornene-2,3-dicarboximide, N-butyl-5-(alpha-hydroxy-alpha-2-pyridylbenzyl)-7-(alpha-2-pyridylbenzylidene)-, endo-
Beilstein Registry Number0906134
CAS Number4634-46-2
InChIKeyMVSUWOJEBQYXFF-KTMFPKCZSA-N
PubChem Substance ID44144574
InChIInChI=1S/C37H33N3O3/c1-2-3-22-40-35(41)32-26-23-27(37(43,25-16-8-5-9-17-25)29-19-11-13-21-39-29)33(34(32)36(40)42)31(26)30(24-14-6-4-7-15-24)28-18-10-12-20-38-28/h4-21,23,26,32-34,43H,2-3,22H2,1H3
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安全信息

RTECSRB8300000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 9 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: 9,537,1966

系列性分类

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