Propionic acid, 2-methyl-2-(phenylthio)- 2-甲基-2-(苯硫基)丙酸

CAS 5219-64-7 MFCD01695512

化学结构图

5219-64-7
SMILES: CC(C)(Sc1ccccc1)C(=O)O

化学属性

Mol. FormulaC10H12O2S
Mol. Weight196.27
Melting Point65-66 °C
Boiling Point125-127 °C at 0.2 mmHg

别名和识别编码

Chemical NamePropionic acid, 2-methyl-2-(phenylthio)-
Chemicalbook IDCB72548284
Wiswesser Line NotationQVX1&1&SR
Synonym 2-Methyl-2-(phenylthio)propanoic acid {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenylthio)propanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-2-(phenyl
CAS Number5219-64-7
Beilstein Registry Number2255431
InChIKeyUYGHXQNQIUVOES-UHFFFAOYSA-N
PubChem Substance ID199886
InChIInChI=1S/C10H12O2S/c1-10(2,9(11)12)13-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)
LabNetwork Molecule IDLN01968048
Chemical Name Translation2-甲基-2-(苯硫基)丙酸
Canonical SMILESCC(C)(C(=O)O)SC1=CC=CC=C1
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安全信息

RTECSUF6105500 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BCFAAI Bollettino Chimico Farmaceutico.  (Societa Editoriale Farmaceutica,
   Via Ausonio 12, 20123 Milan, Italy)  V.33-    1894- Volume(issue)/page/year:
   102,522,1963

Storage condition

系列性分类

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