4,4,4-Trifluoro-1-phenyl-1,3-butanedione

CAS No.：326-06-7

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This product is a chemical product/pharmaceutical intermediate. It is not a drug, an active pharmaceutical ingredient (API), or a pharmaceutical-grade material. It has not been granted a drug approval number or a Chemical Drug Substance Approval Notice, has not passed drug-related review and approval, and is not manufactured, tested, or released in accordance with pharmaceutical GMP.
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4,4,4-Trifluoro-1-phenyl-1,3-butanedione Basic information

Product Name:	4,4,4-Trifluoro-1-phenyl-1,3-butanedione
Synonyms:	TRIFLUORO-1-PHENYL-1,3-BUTANEDIONE;1,1,1-Trifluoro-4-phenyl-2,4-butanedione;1-Benzoyl-3,3,3-trifluoro-2-propanone;1-Benzoyl-3,3,3-trifluoroacetone;4,4,4-Trifluoro-1-phenylbutane-1,3-dione ,98%;ω-(Trifluoroacetyl)acetophenone;4,4,4-Trifluoro-1-phenyl-1,3-butanedione,99%;4-Phenyl-1,1,1-trifluorobuta
CAS:	326-06-7
MF:	C10H7F3O2
MW:	216.16
EINECS:	206-307-8
Product Categories:	organofluorine compounds;Miscellaneous
Mol File:	326-06-7.mol

4,4,4-Trifluoro-1-phenyl-1,3-butanedione Chemical Properties

Melting point	38-40 °C(lit.)
Boiling point	224 °C(lit.)
density	1,113 g/cm³
Fp	210 °F
storage temp.	Sealed in dry,Room Temperature
solubility	95% ethanol: soluble25mg/mL, clear, colorless to yellow
form	Crystalline Low Melting Solid
pka	pK1: 6.35 (25°C)
color	White to yellow
Water Solubility	Sparingly Soluble in water (0.24 g/L) (25°C).
BRN	1875083
InChIKey	VVXLFFIFNVKFBD-UHFFFAOYSA-N
CAS DataBase Reference	326-06-7(CAS DataBase Reference)
EPA Substance Registry System	1,3-Butanedione, 4,4,4-trifluoro-1-phenyl- (326-06-7)

Safety Information

Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	24/25
WGK Germany	3
TSCA	T
HazardClass	IRRITANT
HS Code	29147000

MSDS Information

Provider	Language
SigmaAldrich	English
ACROS	English
ALFA	English

4,4,4-Trifluoro-1-phenyl-1,3-butanedione Usage And Synthesis

Chemical Properties	WHITE TO YELLOW CRYSTALLINE LOW MELTING SOLID
Uses	4,4,4-Trifluoro-1-phenyl-1,3-butanedione was used in the synthesis of series of NNO ketoimines bearing trifluoromethyl substituents via Schiff base condensation reaction. It was also used in mixed-ligand chelate extraction of trivalent lanthanides and as a ligand in the preparation of ternary lanthanide (Ln) complexes.

4,4,4-Trifluoro-1-phenyl-1,3-butanedione Preparation Products And Raw materials

Raw materials	Sodium-->Acetophenone-->Ethyl trifluoroacetate
Preparation Products	2-OXO-6-PHENYL-4-(TRIFLUOROMETHYL)-1,2-DIHYDRO-3-PYRIDINECARBONITRILE

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