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2-(4-Fluorophenyl)-thiophene

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2-(4-Fluorophenyl)-thiophene Basic information

Product Name:
2-(4-Fluorophenyl)-thiophene
Synonyms:
  • IFLAB-BB F2108-0130
  • 2-(4-FLUOROPHENYL)THIOPHENE
  • AKOS BAR-1344
  • Thiophene, 2-(4-fluorophenyl)-
  • Canagliflozin intermediate
  • Canagliflozin Intermediate I
  • Canagliflozin INT2
  • 2-(4-fluorophenyl)thiophen
CAS:
58861-48-6
MF:
C10H7FS
MW:
178.23
EINECS:
611-756-1
Product Categories:
  • 58861-48-6
Mol File:
58861-48-6.mol
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2-(4-Fluorophenyl)-thiophene Chemical Properties

Melting point:
51.0 to 55.0 °C
Boiling point:
252.3±15.0 °C(Predicted)
Density 
1.200±0.06 g/cm3(Predicted)
storage temp. 
2-8°C(protect from light)
solubility 
soluble in Methanol
form 
powder to crystal
color 
Light orange to Yellow to Green
InChI
InChI=1S/C10H7FS/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H
InChIKey
PURJRGMZIKXDMW-UHFFFAOYSA-N
SMILES
C1(C2=CC=C(F)C=C2)SC=CC=1
CAS DataBase Reference
58861-48-6
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Safety Information

HS Code 
2934999090
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2-(4-Fluorophenyl)-thiophene Usage And Synthesis

Chemical Properties

white solid

Uses

2-(4-Fluorophenyl)-thiophene can be used to prepare Canagliflozin (C175190) as sodium-dependent glucose co-transporter 2 (SGLT2) inhibitor for treatment of type 2 diabetes mellitus.

Synthesis

4-fluorobenzoic boric acid and 2-bromothiophene, Pd catalyst are added in organic solvent and dissolves, obtain material 3, wherein: 4-fluorine Phenylboric acid molar concentration in organic solvent is 0.5mol/L~2mol/L, and 4-fluorobenzoic boric acid with the mol ratio of 2-bromothiophene is 1:1.0~1:1.5,4-fluorobenzoic boric acid is 1:0.005~1:0.1 with the mol ratio of catalyst;Using material 3 with as material 4 Inorganic base aqueous solution carries out pre-incubation respectively to being 1:1.0~1 according to the mol ratio of 4-fluorobenzoic boric acid Yu alkali after reaction temperature: The mode of 3.0 mixes, and reacts under conditions of 50 ℃~80 ℃, then carries out post processing and obtains 2-(4-fluorophenyl) Thiophene.

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