Ethanethiol, 2-(4-nonyl)amino-, hydrogen sulfate (ester)

CAS 924-08-3 MFCD00924083

化学结构图

924-08-3
SMILES: CCCCC[C@H](CCC)NCCSS(=O)(=O)O

化学属性

Mol. Weight283.49
Mol. FormulaC11H25NO3S2

别名和识别编码

Wiswesser Line NotationWSQS2MY5&3
Chemical NameEthanethiol, 2-(4-nonyl)amino-, hydrogen sulfate (ester)
Synonym WR 2386 2-(4-Nonyl)aminoethanethiol hydrogen sulfate (ester) Ethanethiol, 2-((1-propylhexyl)amino)-, hydrogen sulfate (ester) Thiosulfuric acid, S-(2-((1-propylhexyl)amino)ethyl) ester
Beilstein Registry Number2368332
CAS Number924-08-3
InChIKeyODWHXYVTBJEFNG-UHFFFAOYSA-N
PubChem Substance ID102508
InChIInChI=1S/C11H25NO3S2/c1-3-5-6-8-11(7-4-2)12-9-10-16-17(13,14)15/h11-12H,3-10H2,1-2H3,(H,13,14,15)
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安全信息

RTECSKJ2502000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 200 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: 13,251,1970

系列性分类

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