Ethanethiol, 2-undecylamino-, hydrogen sulfate (ester)

CAS 929-39-5 MFCD N/A

化学结构图

929-39-5
SMILES: CCCCCCCCCCCNCCSS(=O)(=O)O

化学属性

Mol. Weight311.55
Mol. FormulaC13H29NO3S2

别名和识别编码

Wiswesser Line NotationWSQS2M11
Chemical NameEthanethiol, 2-undecylamino-, hydrogen sulfate (ester)
Synonym 2-Undecylaminoethanethiol hydrogen sulfate (ester)
Beilstein Registry Number2373192
CAS Number929-39-5
Chemicalbook IDCB92195312
InChIKeyAUEJBFDAJLTUHB-UHFFFAOYSA-N
PubChem Substance ID70238
InChIInChI=1S/C13H29NO3S2/c1-2-3-4-5-6-7-8-9-10-11-14-12-13-18-19(15,16)17/h14H,2-13H2,1H3,(H,15,16,17)
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安全信息

RTECSKJ2625100 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 8 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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