5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE

Modify Date: 2025-08-25 18:42:58

5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE Structure
5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE structure
 Common Name 5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE
CAS Number 889938-97-0 Molecular Weight 205.18500
Density 1.232g/cm3 Boiling Point 369.1ºC at 760 mmHg
Molecular Formula C11H8FNO2 Melting Point N/A
MSDS N/A Flash Point 177ºC

 Names

Name 1-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]ethanone

 Chemical & Physical Properties

Density 1.232g/cm3
Boiling Point 369.1ºC at 760 mmHg
Molecular Formula C11H8FNO2
Molecular Weight 205.18500
Flash Point 177ºC
Exact Mass 205.05400
PSA 43.10000
LogP 2.68330
Index of Refraction 1.527
InChIKey FYOVARWWAUYDFV-UHFFFAOYSA-N
SMILES CC(=O)c1cc(-c2ccc(F)cc2)no1

 Synthetic Route

1-(3-(4-fluorophenyl)isoxazol-5-yl)ethanol structure

1-(3-(4-fluorop...

CAS#:1429330-61-9

~66%

5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE Structure

5-ACETYL-3(4-FL...

CAS#:889938-97-0

Literature: ENDO PHARMACEUTICALS INC.; SMITH, Roger, Astbury; KETHIRI, Raghava, Reddy; KRISTAM, Rajendra; LAPING, Nicholas, James; VENKATESHAPPA, Chandregowda; KULKARNI, Bheemashankar; DEVRAJ, Rajesh; DEWANG, Purushottam Patent: WO2013/49559 A1, 2013 ; Location in patent: Page/Page column 95 ;
p-Fluorobenzaldehyde oxime structure

p-Fluorobenzald...

CAS#:459-23-4

~%

5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE Structure

5-ACETYL-3(4-FL...

CAS#:889938-97-0

Literature: ENDO PHARMACEUTICALS INC.; SMITH, Roger, Astbury; KETHIRI, Raghava, Reddy; KRISTAM, Rajendra; LAPING, Nicholas, James; VENKATESHAPPA, Chandregowda; KULKARNI, Bheemashankar; DEVRAJ, Rajesh; DEWANG, Purushottam Patent: WO2013/49559 A1, 2013 ;
4-Fluorobenzaldehyde structure

4-Fluorobenzaldehyde

CAS#:459-57-4

~%

5-ACETYL-3(4-FLUOROPHENYL)-ISOXAZOLE Structure

5-ACETYL-3(4-FL...

CAS#:889938-97-0

Literature: ENDO PHARMACEUTICALS INC.; SMITH, Roger, Astbury; KETHIRI, Raghava, Reddy; KRISTAM, Rajendra; LAPING, Nicholas, James; VENKATESHAPPA, Chandregowda; KULKARNI, Bheemashankar; DEVRAJ, Rajesh; DEWANG, Purushottam Patent: WO2013/49559 A1, 2013 ;

 Precursor & DownStream

Precursor  2

DownStream  0

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