ChemicalBook--->CAS DataBase List--->133116-83-3

133116-83-3

133116-83-3 Structure

133116-83-3 Structure
IdentificationMore
[Name]

2-FLUORO-6-(TRIFLUOROMETHYL)BENZONITRILE
[CAS]

133116-83-3
[Synonyms]

2-CYANO-3-FLUOROBENZOTRIFLUORIDE
2-FLUORO-6-(TRIFLUOROMETHYL)BENZONITRILE
ALPHA,ALPHA,ALPHA,6-TETRAFLUORO-O-TOLUNITRILE
2-Cyano-3-fluorobenzotrifluoride~alpha,alpha,alpha,6-Tetrafluoro-o-tolunitrile
à,à,à,6-tetrafluoro-o-tolunitrile
α,α,α,6-tetrafluoro-o-tolunitrile
2-Fluoro-6-(trifluoromethyl)benzonitrile97%
[EINECS(EC#)]

627-838-5
[Molecular Formula]

C8H3F4N
[MDL Number]

MFCD00061153
[Molecular Weight]

189.11
[MOL File]

133116-83-3.mol
Chemical PropertiesBack Directory
[Melting point ]

26-28°C
[Boiling point ]

178°C (rough estimate)
[density ]

1.373 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.452(lit.)
[Fp ]

210 °F
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to lump
[color ]

White to Almost white
[Specific Gravity]

1.373
[BRN ]

4312131
[InChI]

1S/C8H3F4N/c9-7-3-1-2-6(5(7)4-13)8(10,11)12/h1-3H
[InChIKey]

OGQYJDHTHFAPRN-UHFFFAOYSA-N
[SMILES]

Fc1cccc(c1C#N)C(F)(F)F
[CAS DataBase Reference]

133116-83-3(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,T,Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
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 ]

3276
[WGK Germany ]

3
[Hazard Note ]

Toxic
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29269090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

2-Fluoro-6-(trifluoromethyl)benzonitrile may be used in chemical synthesis.
[Uses]

2-Fluoro-6-(trifluoromethyl)benzonitrile acts as a reagent in the synthesis of Quinolinecarboxamides for the treatment of autoimmune disorders.
Spectrum DetailBack Directory
[Spectrum Detail]

2-FLUORO-6-(TRIFLUOROMETHYL)BENZONITRILE(133116-83-3)1HNMR
2-FLUORO-6-(TRIFLUOROMETHYL)BENZONITRILE(133116-83-3)19FNMR
2-FLUORO-6-(TRIFLUOROMETHYL)BENZONITRILE(133116-83-3)IR
2-FLUORO-6-(TRIFLUOROMETHYL)BENZONITRILE(133116-83-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Fluoro-6-(trifluoromethyl)benzonitrile, 97%(133116-83-3)
[Sigma Aldrich]

133116-83-3(sigmaaldrich)
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