Ethanethiol, 2-tert-butylamino-, hydrogen sulfate (ester)

CAS 926-52-3 MFCD00926523

化学结构图

926-52-3
SMILES: CC(C)(C)NCCSS(=O)(=O)O

化学属性

Mol. Weight213.34
Mol. FormulaC6H15NO3S2

别名和识别编码

Wiswesser Line NotationWSQS2MX1&1&1
Chemical NameEthanethiol, 2-tert-butylamino-, hydrogen sulfate (ester)
Synonym 2-tert-Butylaminoethanethiol hydrogen sulfate (ester)
Beilstein Registry Number2357891
CAS Number926-52-3
Chemicalbook IDCB22301402
InChIKeyDEGNVZJJUSWXDF-UHFFFAOYSA-N
PubChem Substance ID70224
InChIInChI=1S/C6H15NO3S2/c1-6(2,3)7-4-5-11-12(8,9)10/h7H,4-5H2,1-3H3,(H,8,9,10)
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安全信息

RTECSKJ0345000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 250 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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