2-Oxopropyl benzoate 2-氧代丙基苯甲酸酯

CAS 6656-60-6 MFCD01660185

化学结构图

6656-60-6
SMILES: CC(=O)COC(=O)c1ccccc1

化学属性

Mol. FormulaC10H10O3
Mol. Weight178.18
Melting Point22-24 °C
Boiling Point140 °C at 10 mmHg

别名和识别编码

Chemical Name2-Oxopropyl Benzoate
InChIKeyJJANSRGIKCRCFG-UHFFFAOYSA-N
Wiswesser Line Notation1V1OVR
Synonym 2-Oxopropyl benzoate {LY} 2-Oxopropyl benzoate {} {LY} 2-Oxopropyl benzoate {} {} {LY} 2-Oxopropyl benzoate {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Oxopropyl benzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {}
CAS Number6656-60-6
Beilstein Registry Number1949247
LabNetwork Molecule IDLN02039872
PubChem Substance ID23137
InChIInChI=1S/C10H10O3/c1-8(11)7-13-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H3
Chemical Name Translation2-氧代丙基苯甲酸酯
MDL NumberMFCD01660185
Canonical SMILESCC(COC(C1=CC=CC=C1)=O)=O
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安全信息

RTECSDG0925000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 20,644,1977

Storage condition

系列性分类

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