4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione

4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione
  • CAS No.:720-94-5
Other grades of this product :
4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione Basic information
Product Name:4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione
Synonyms:4-Trifluoro-1-(4-methylphenyl)-1,3-butanedione;4,4,4-Trifluoro-1-(4-Methylphenyl)-1,3-Butanedione;1-(4-Methylphenyl)-4,4,4-Triflurobutane-1,3-Dione;3-(4-METHYLBENZOYL)-1,1,1-TRIFLUOROACETONE;1-(4-METHYLPHENYL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE;AKOS MSC-0332;AKOS B007344;4,4,4-TRIFLUORO-1-P-TOLYL-BUTANE-1,3-DIONE
CAS:720-94-5
MF:C11H9F3O2
MW:230.18
EINECS:615-712-2
Product Categories:API intermediates;(intermediate of celecoxib);Aromatics Compounds;Osteoarthritis and Rheumatoid Arthritis;Aromatics;Intermediates & Fine Chemicals;Pharmaceuticals;pharmaceutical
Mol File:720-94-5.mol
4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione Chemical Properties
Melting point 44-46°C
Boiling point 269.9±35.0 °C(Predicted)
density 1.252±0.06 g/cm3(Predicted)
vapor pressure 0.633Pa at 20℃
storage temp. Keep in dark place,Sealed in dry,Room Temperature
solubility Chloroform (Sparingly), Methanol (Slightly)
pka5.91±0.25(Predicted)
form Solid
color Off-White to Light Beige
Water Solubility 526.4mg/L at 20℃
InChIKeyWRZMHTIRFOFFPY-UHFFFAOYSA-N
LogP1.95 at 20℃
CAS DataBase Reference720-94-5(CAS DataBase Reference)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36/37/39
HazardClass IRRITANT
HS Code 2914790090
MSDS Information
4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione Usage And Synthesis
Chemical PropertiesPale Yellow Solid
UsesA Celecoxib (Celebrex) intermediate.
UsesA Celecoxib (Celebrex) intermediate
Flammability and ExplosibilityNonflammable
4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione Preparation Products And Raw materials
Preparation ProductsN-De(4-sulfonaMidophenyl)-N'-(4-sulfonaMidophenyl) Celecoxib

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