ISOQUINOLINIUM, 2-DODECYL-, p-TOLUENESULFONATE

CAS 5412-37-3 MFCD N/A

化学结构图

5412-37-3
SMILES: CCCCCCCCCCCC[n+]1ccc2ccccc2c1.Cc1ccc(S(=O)(=O)[O-])cc1

化学属性

Mol. Weight469.74
Mol. FormulaC21H32N.C7H7O3S

别名和识别编码

Synonym 2-Dodecylisoquinolinium p-toluenesulfonate
Wiswesser Line NotationT66 CKJ C12 &Q &WSO&R D1
Chemical NameIsoquinolinium, 2-dodecyl-, p-toluenesulfonate
CAS Number5412-37-3
InChIKeySZDIFSKUQQLAMT-UHFFFAOYSA-M
PubChem Substance ID21517
InChIInChI=1S/C21H32N.C7H8O3S/c1-2-3-4-5-6-7-8-9-10-13-17-22-18-16-20-14-11-12-15-21(20)19-22;1-6-2-4-7(5-3-6)11(8,9)10/h11-12,14-16,18-19H,2-10,13,17H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
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安全信息

RTECSNX5425000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3900 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CBCCT* "Summary Tables of Biological Tests," National Research Council
   Chemical-Biological Coordination Center.  (National Academy of Science
   Library, 2101 Constitution Ave., NW, Washington, DC 20418)
   Volume(issue)/page/year: 6,374,1954

系列性分类

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