Nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-, butyl ester

CAS 5497-45-0 MFCD05497450

化学结构图

5497-45-0
SMILES: CCCCOC(=O)C1=CCCN(C)C1

化学属性

Mol. FormulaC11H19NO2
Mol. Weight197.31

别名和识别编码

Synonym n-Butyl-1-methyl-1,2,5,6-tetrahydronicotinate
Wiswesser Line NotationT6N CUTJ A1 CVO4
Chemical NameNicotinic acid, 1,2,5,6-tetrahydro-1-methyl-, butyl ester
CAS Number5497-45-0
Beilstein Registry Number0136369
InChIKeyFPSVFGKQHLLPOQ-UHFFFAOYSA-N
PubChem Substance ID21666
InChIInChI=1S/C11H19NO2/c1-3-4-8-14-11(13)10-6-5-7-12(2)9-10/h6H,3-5,7-9H2,1-2H3
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安全信息

RTECSQT2080000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 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#12548

系列性分类

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