2-Benzimidazolinone, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-piperidyl)-3-hydroxymethyl-

CAS 1814-13-7 MFCD N/A

化学结构图

1814-13-7
SMILES: O=C(CCCN1CCC(n2c(=O)n(CO)c3ccccc32)CC1)c1ccc(F)cc1

化学属性

Mol. FormulaC23H26FN3O3
Mol. Weight411.52

别名和识别编码

Synonym 1-(1-(gamma-(4-Fluorobenzoyl)-propyl)-4-piperidyl)-3-hydroxymethyl-2-benzimidazolinone
Wiswesser Line NotationT56 BNVNJ B1Q D- DT6NTJ A3VR DF
Chemical Name2-Benzimidazolinone, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-piperidyl)-3-hydroxymethyl-
CAS Number1814-13-7
Beilstein Registry Number0902604
InChIKeyACQRYVMWVNCRDN-UHFFFAOYSA-N
PubChem Substance ID98819
InChIInChI=1S/C23H26FN3O3/c24-18-9-7-17(8-10-18)22(29)6-3-13-25-14-11-19(12-15-25)27-21-5-2-1-4-20(21)26(16-28)23(27)30/h1-2,4-5,7-10,19,28H,3,6,11-16H2
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安全信息

RTECSDE1940000 
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#11205

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物

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