| Identification | More | [Name]
2,3,5,6-Tetrafluorophenol | [CAS]
769-39-1 | [Synonyms]
2,3,5,6-TETRAFLUOROPHENOL
Phenol, 2,3,5,6-tetrafluoro-
Tfp-OH
Tetrafluorophenolminwhitewaxysolid
2,3,5,6-Tetrafluorophenol, 97+%
2,3,5,6-Tetrafluorophenol,tech.
2,3,5,6-Tetrafluorophenol 98%
2,3,5,6-Tetrafluorophenol98%
Tfp-OH (Tetramethylfluoroformamidiniun hexafluorophosphate) | [EINECS(EC#)]
212-209-6 | [Molecular Formula]
C6H2F4O | [MDL Number]
MFCD00002157 | [Molecular Weight]
166.07 | [MOL File]
769-39-1.mol |
| Chemical Properties | Back Directory | [Appearance]
white solid | [Melting point ]
37-39 °C (lit.) | [Boiling point ]
140 °C (lit.) | [density ]
1.4445 (estimate) | [Fp ]
175 °F
| [storage temp. ]
Keep in dark place,Inert atmosphere,Room temperature | [form ]
Crystalline Low Melting Solid | [pka]
5.46±0.20(Predicted) | [color ]
White | [Stability:]
Stable. Incompatible with acid chlorides, acid anhydrides, oxidizing agents. | [Water Solubility ]
Partly miscible with water. | [BRN ]
1911548 | [InChI]
InChI=1S/C6H2F4O/c7-2-1-3(8)5(10)6(11)4(2)9/h1,11H | [InChIKey]
PBYIIRLNRCVTMQ-UHFFFAOYSA-N | [SMILES]
C1(O)=C(F)C(F)=CC(F)=C1F | [CAS DataBase Reference]
769-39-1(CAS DataBase Reference) | [NIST Chemistry Reference]
2,3,5,6-Tetrafluorophenol(769-39-1) |
| Safety Data | Back 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:Wear suitable protective clothing . | [RIDADR ]
UN3261 | [WGK Germany ]
3
| [Hazard Note ]
Irritant | [HazardClass ]
8 | [PackingGroup ]
III | [HS Code ]
29081990 |
| Hazard Information | Back Directory | [Chemical Properties]
white solid | [Uses]
2,3,5,6-Tetrafluorophenol is a reagent in the preparation of polyfluorophenyl ester-terminated homobifunctional cross-linkers to be used in protein conjugation. | [Synthesis]
Chalcone 1d (1.0 g, 3.4 mmol) was added to a 10 mL DMF solution containing guanidine hydrochloride (0.64 g, 6.7 mmol) and sodium hydride (0.32 g, 13.4 mmol). The reaction mixture was stirred at 50 °C for 1.5 h before being cooled to room temperature and subsequently poured into ice water and extracted with ethyl acetate. Undissolved material at the phase boundary was removed by filtration, resulting in the isolation of 2-amino-6-phenyl-5,6-dihydropyrimidin-4(1H)-one (7a, 0.1 g, 16% yield). The 1H NMR data and melting point (255-257 °C; literature value 257.3 °C [19]) of this product were in agreement with those reported in the literature [19]. The extract was washed with water and dried with CaCl2 and concentrated under reduced pressure to remove the solvent, yielding 0.29 g of residue, which was analyzed by NMR and GC/MS. | [References]
[1] Russian Journal of Organic Chemistry, 2015, vol. 51, # 12, p. 1745 - 1752
[2] Zh. Org. Khim., 2015, vol. 51, # 12, p. 1778 - 1785,8 |
| Spectrum Detail | Back Directory | [Spectrum Detail]
2,3,5,6-Tetrafluorophenol(769-39-1)MS
2,3,5,6-Tetrafluorophenol(769-39-1)1HNMR
2,3,5,6-Tetrafluorophenol(769-39-1)13CNMR
2,3,5,6-Tetrafluorophenol(769-39-1)IR1
2,3,5,6-Tetrafluorophenol(769-39-1)Raman
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| Well-known Reagent Company Product Information | Back Directory | [Acros Organics]
2,3,5,6-Tetrafluorophenol, 98%(769-39-1) | [Alfa Aesar]
2,3,5,6-Tetrafluorophenol, 97%(769-39-1) | [Sigma Aldrich]
769-39-1(sigmaaldrich) | [TCI AMERICA]
2,3,5,6-Tetrafluorophenol,>98.0%(T)(769-39-1) |
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