Pyridinium, 3-(aminocarbonyl)-1-(phenylmethyl)-, chloride (1:1)

CAS 5096-13-9 MFCD N/A

化学结构图

5096-13-9
SMILES: NC(=O)c1ccc[n+](Cc2ccccc2)c1.[Cl-]

化学属性

Mol. FormulaC13H13N2O.Cl
Mol. Weight248.73

别名和识别编码

Chemical NamePyridinium, 3-(aminocarbonyl)-1-(phenylmethyl)-, chloride (1:1)
Chemicalbook IDCB6779559
Wiswesser Line NotationT6KJ A1R CVZ &G
Synonym N-Benzylnicotinamide chloride 1-Benzylnicotinamide chloride N1-Benzylnicotinamide chloride 1-Benzyl-3-carbamoylpyridinium chloride 1-Benzylnicotinamidinium chloride
CAS Number5096-13-9
InChIKeyXLYNVJJFQHWCEU-UHFFFAOYSA-N
PubChem Substance ID78774
InChIInChI=1S/C13H12N2O.ClH/c14-13(16)12-7-4-8-15(10-12)9-11-5-2-1-3-6-11;/h1-8,10H,9H2,(H-,14,16);1H
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安全信息

RTECSUU2350000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 308 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 16,44,1966

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 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#03579

系列性分类

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