ChemicalBook--->CAS DataBase List--->6226-25-1

6226-25-1

6226-25-1 Structure

6226-25-1 Structure
IdentificationMore
[Name]

2,2,2-Trifluoroethyl trifluoromethanesulfonate
[CAS]

6226-25-1
[Synonyms]

2,2,2-TRIFLUOROETHYL TRIFLATE
2,2,2-TRIFLUOROETHYL TRIFLUOROMETHANESULFONATE
2,2,2-TRIFLUOROETHYL TRIFLUOROMETHANESULPHONATE
TFOL-TF
TRIFLUOROMETHANESULFONIC ACID 2,2,2-TRIFLUOROETHYL ESTER
2,2,2-trifluoroethyltrifluorometanesulfonicacid
methanesulfonicacid,trifluoro-,2,2,2-trifluoroethylester
2,2,2-Trifluoroethyl trifluoromethanesulphonate 97%
2,2,2-Trifluoroethyltrifluoromethanesulphonate97%
TRIFLUOROMETHANESULPHONICACID2,2,2-TRIFLUOROETHYLESTER
[EINECS(EC#)]

458-390-7
[Molecular Formula]

C3H2F6O3S
[MDL Number]

MFCD00671579
[Molecular Weight]

232.1
[MOL File]

6226-25-1.mol
Chemical PropertiesBack Directory
[Boiling point ]

89-91°C
[density ]

1,61 g/cm3
[refractive index ]

1.3037
[RTECS ]

PB2775000
[Fp ]

>110°(230°F)
[storage temp. ]

2-8°C
[solubility ]

Chloroform, Methanol (Slightly)
[form ]

Liquid
[color ]

Colorless to yellow
[Water Solubility ]

Slightly soluble in water.
[Sensitive ]

Moisture Sensitive
[InChI]

InChI=1S/C3H2F6O3S/c4-2(5,6)1-12-13(10,11)3(7,8)9/h1H2
[InChIKey]

RTMMSCJWQYWMNK-UHFFFAOYSA-N
[SMILES]

C(F)(F)(F)S(OCC(F)(F)F)(=O)=O
[CAS DataBase Reference]

6226-25-1(CAS DataBase Reference)
[EPA Substance Registry System]

6226-25-1(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Skull and Crossbones (GHS06)
GHS05,GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H314-H330
[Precautionary statements ]

P260-P270-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

Xi,T,C
[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 .
[RIDADR ]

3265
[WGK Germany ]

3
[Hazard Note ]

Irritant
[REACH Registrations]

Active
[HazardClass ]

8
[HazardClass ]

TOXIC, CORROSIVE
[PackingGroup ]

Ⅱ
[HS Code ]

29055900
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Inhalation
Acute Tox. 3 Oral
Skin Corr. 1B
Hazard InformationBack Directory
[Uses]

A fluorine-containing alkyl alkanesulfonate with cyctotoxity towards cultured leukemia L1210 cells.
[Synthesis]

In a 100-ml flask equipped with a stirrer, a thermometer, a nitrogen introducing pipe, and a condenser, 50 ml (0.297 mol) of trifluoromethane sulfonic anhydride and 25 ml (0.342 moles) of 2,2,2-trifluoroethanol were placed at room temperature and stirred for 30 minutes in a nitrogen atmosphere, followed by reflux for 3 hours. After distillation, 50.3 g of 2,2,2-trifluoroethyl trifluoromethanesulfonate was obtained in a yield of 73%.
2,2,2-Trifluoroethyl trifluoromethanesulfonate
[References]

[1] Patent: US2014/249162, 2014, A1. Location in patent: Paragraph 0423; 0424; 0425
[2] Patent: EP2781519, 2014, A1. Location in patent: Paragraph 0404; 0405; 0406
[3] Tetrahedron, 1988, vol. 44, # 17, p. 5375 - 5387
[4] Journal of Organic Chemistry, 1984, vol. 49, # 12, p. 2258 - 2273
[5] Journal of Fluorine Chemistry, 2016, vol. 192, p. 131 - 140
Spectrum DetailBack Directory
[Spectrum Detail]

2,2,2-Trifluoroethyl trifluoromethanesulfonate(6226-25-1)1HNMR
2,2,2-Trifluoroethyl trifluoromethanesulfonate(6226-25-1)FT-IR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

2,2,2-Trifluoroethyl Trifluoromethanesulfonate,>95.0%(GC)(6226-25-1)
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