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247564-71-2

247564-71-2 Structure

247564-71-2 Structure
IdentificationMore
[Name]

2,3,6-Trifluorophenylboronic acid
[CAS]

247564-71-2
[Synonyms]

2,3,5-TRIFLUOROBENZENEBORONIC ACID
2,3,5-TRIFLUOROPHENYLBORONIC ACID
2,4,5-TRIFLUOROBENZENEBORONIC ACID
2,4,5-TRIFLUOROPHENYLBORONIC ACID
RARECHEM AH PB 0119
RARECHEM AH PB 0123
[Molecular Formula]

C6H4BF3O2
[MDL Number]

MFCD01863165
[Molecular Weight]

175.9
[MOL File]

247564-71-2.mol
Chemical PropertiesBack Directory
[Melting point ]

127-132 °C (lit.)
[Boiling point ]

266.0±50.0 °C(Predicted)
[density ]

1.44±0.1 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

solid
[pka]

7.09±0.58(Predicted)
[color ]

Off White
[InChI]

InChI=1S/C6H4BF3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,11-12H
[InChIKey]

IWPDDRPLEKURGG-UHFFFAOYSA-N
[SMILES]

B(C1=C(F)C=CC(F)=C1F)(O)O
[CAS DataBase Reference]

247564-71-2(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

2931900090
[Storage Class]

13 - Non Combustible Solids
Hazard InformationBack Directory
[Uses]

Reactant for:
  • Synthesis of C-6 hydroxy tricyclic sulfone as a γ-secretase inhibitor via Suzuki coupling reaction
  • Palladium catalyzed Suzuki-Miyaura coupling reactions
[General Description]

Contains varying amounts of anhydride.
Spectrum DetailBack Directory
[Spectrum Detail]

2,3,6-Trifluorophenylboronic acid(247564-71-2)IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

247564-71-2(sigmaaldrich)
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