Caffeine, 8-(isopentylthio)-

CAS 73747-35-0 MFCD01737723

化学结构图

73747-35-0
SMILES: CC(C)CCSC1=NC2=C(C(=O)N(C)C(=O)N2C)N1C

化学属性

Mol. FormulaC13H20N4O2S
Mol. Weight296.43

别名和识别编码

Chemical NameCaffeine, 8-(isopentylthio)-
Synonym 8-(Isopentylthio)caffeine
Wiswesser Line NotationT56 BN DN FNVNVJ B1 CS2Y1&1 F1 H1
CAS Number73747-35-0
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安全信息

RTECSEV6570000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 32 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#02443

系列性分类

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