Benzoic acid, 2-(allyloxy)-3,5-dipropyl-, methyl ester

CAS 7192-45-2 MFCD07192452

化学结构图

7192-45-2
SMILES: C=CCOc1c(CCC)cc(CCC)cc1C(=O)OC

化学属性

Mol. Weight276.41
Mol. FormulaC17H24O3

别名和识别编码

Wiswesser Line Notation1U2OR B3 D3 FVO1
Chemical NameBenzoic acid, 2-(allyloxy)-3,5-dipropyl-, methyl ester
Synonym Methyl 2-allyloxy-3,5-dipropylbenzoate 2-Allyloxy-3,5-dipropylbenzoic acid methyl ester
Beilstein Registry Number2620290
CAS Number7192-45-2
InChIKeyWXPMMBRGRMMZIO-UHFFFAOYSA-N
PubChem Substance ID23585
InChIInChI=1S/C17H24O3/c1-5-8-13-11-14(9-6-2)16(20-10-7-3)15(12-13)17(18)19-4/h7,11-12H,3,5-6,8-10H2,1-2,4H3
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安全信息

RTECSDG0997850 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 650 mg/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
   Behavioral - changes in motor activity (specific assay)
REFERENCE :
   JMPCAS Journal of Medicinal and Pharmaceutical Chemistry.  (Washington, DC)
   V.1-5, 1959-62.  For publisher information, see JMCMAR.
   Volume(issue)/page/year: 2,213,1960

系列性分类

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