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461-17-6

461-17-6 Structure

461-17-6 Structure
IdentificationMore
[Name]

1-IODO-4,4,4-TRIFLUOROBUTANE
[CAS]

461-17-6
[Synonyms]

1,1,1-TRIFLUORO-4-IODOBUTANE
1-IODO-4,4,4-TRIFLUOROBUTANE
4,4,4-TRIFLUORO-1-IODOBUTANE
4,4,4-TRIFLUOROBUTYL IODIDE
4-IODO-1,1,1-TRIFLUOROBUTANE
4,4,4-Trifluorobutyl iodide~4,4,4-Trifluoro-1-iodobutane
1-Iodo-4,4,4-trifluorobutane 99%
1-Iodo-4,4,4-trifluorobutane99%
1-IODO-4,4,4-TRIFLUOROBUTANE, 98+%
1,1,1-Trifluoro-4-iodobutane, 98+%
[Molecular Formula]

C4H6F3I
[MDL Number]

MFCD00041543
[Molecular Weight]

237.99
[MOL File]

461-17-6.mol
Chemical PropertiesBack Directory
[Boiling point ]

126 °C
[density ]

1.85
[refractive index ]

1.4326
[Fp ]

>100°C
[storage temp. ]

Keep in dark place,Sealed in dry,2-8°C
[form ]

clear liquid
[color ]

Colorless to Light yellow to Light orange
[Sensitive ]

Light Sensitive
[BRN ]

1736064
[InChI]

InChI=1S/C4H6F3I/c5-4(6,7)2-1-3-8/h1-3H2
[InChIKey]

LNDGACQEAYKNOI-UHFFFAOYSA-N
[SMILES]

C(F)(F)(F)CCCI
[CAS DataBase Reference]

461-17-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29037990
Hazard InformationBack Directory
[Description]

1,1,1-Trifluoro-4-iodobutane is an organic compound with the chemical formula CIF3. It is a colorless liquid that reacts with water and alcohol to form hydrogen fluoride and hydrofluoric acid. 1,1,1-Trifluoro-4-iodobutane is a potent sensitizer that can irritate the skin and eyes. It has been used experimentally as a solvent for diethyl ether in the synthesis of piperidinium salts. The cavity viscosity of 1,1,1-trifluoro-4-iodobutane has been measured at room temperature and found to be 0.0038 Pa·s at 25 °C. In laboratory tests, this molecule has shown antibacterial activity against Propionibacterium acnes (P. acnes) and Staphylococcus aureus (S. aureus).
[Uses]

1,1,1-Trifluoro-4-Iodobutane can be used to prepare small molecule inhibitors of SLC15A4 possessing anti-inflammatory activity.
[Synthesis]

In a 1.0 L reactor add 0.8 g of 18-crown-6, 3 mol of CF3CH2CH2CH2Cl, 1.5 mol of potassium iodide and After 500 ml of acetone, the reactor was sealed. With stirring on, the reactor was warmed up to 90 °C and reacted at a constant temperature for 6 h. The
Spectrum DetailBack Directory
[Spectrum Detail]

1,1,1-Trifluoro-4-iodobutane(461-17-6)MS
1,1,1-Trifluoro-4-iodobutane(461-17-6)1HNMR
1,1,1-Trifluoro-4-iodobutane(461-17-6)IR1
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

1,1,1-Trifluoro-4-iodobutane, 98+%(461-17-6)
[Sigma Aldrich]

461-17-6(sigmaaldrich)
[TCI AMERICA]

1,1,1-Trifluoro-4-iodobutane,>98.0%(GC)(461-17-6)
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