Coumarin, 3-(p-chloro-alpha-ethylbenzyl)-4-hydroxy-

CAS 2728-02-1 MFCD02728021

化学结构图

2728-02-1
SMILES: CCC(c1ccc(Cl)cc1)c1c(O)c2ccccc2oc1=O

化学属性

Mol. FormulaC18H15ClO3
Mol. Weight314.78

别名和识别编码

Chemical NameCoumarin, 3-(p-chloro-alpha-ethylbenzyl)-4-hydroxy-
Synonym 2H-1-Benzopyran-2-one, 3-(1-(4-chlorophenyl)propyl)-4-hydroxy- 3-(1'-(p-Chlorophenyl)-propyl)-4-oxy-cumarin 3-(p-Chloro-alpha-ethylbenzyl)-4-hydroxycoumarin
CAS Number2728-02-1
Beilstein Registry Number1351487
Chemicalbook IDCB01408027
InChIKeyQGCOFSZSZWRICF-UHFFFAOYSA-N
PubChem Substance ID54678487
InChIInChI=1S/C18H15ClO3/c1-2-13(11-7-9-12(19)10-8-11)16-17(20)14-5-3-4-6-15(14)22-18(16)21/h3-10,13,20H,2H2,1H3
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安全信息

RTECSGN5000000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 80 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und
   Pharmakologie.  (Berlin, Ger.) V.110-253, 1925-66.  For publisher
   information, see NSAPCC.  Volume(issue)/page/year: 222,107,1954

系列性分类

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