ChemicalBook--->CAS DataBase List--->136514-17-5

136514-17-5

136514-17-5 Structure

136514-17-5 Structure
IdentificationMore
[Name]

2,3,6-Trifluorobenzonitrile
[CAS]

136514-17-5
[Synonyms]

2,3,6-TRIFLUOROBENZONITRILE
Benzonitrile, 2,3,6-trifluoro-(9CI)
3-flurobenzalcohol
2,3,6-Trifluorobenzonitrile 99%
2,3,6-Trifluorobenzonitrile99%
[Molecular Formula]

C7H2F3N
[MDL Number]

MFCD00012287
[Molecular Weight]

157.09
[MOL File]

136514-17-5.mol
Chemical PropertiesBack Directory
[Boiling point ]

179°C
[density ]

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

n20/D 1.4706(lit.)
[Fp ]

174 °F
[storage temp. ]

Storage temp. 2-8°C
[form ]

liquid
[color ]

Clear, colourless
[Specific Gravity]

1.360
[BRN ]

5427616
[InChI]

InChI=1S/C7H2F3N/c8-5-1-2-6(9)7(10)4(5)3-11/h1-2H
[InChIKey]

YWTXHALVWAISPR-UHFFFAOYSA-N
[SMILES]

C(#N)C1=C(F)C=CC(F)=C1F
[CAS DataBase Reference]

136514-17-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

T,Xi,Xn
[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 .
S36/37:Wear suitable protective clothing and gloves .
S38:In case of insufficient ventilation, wear suitable respiratory equipment .
S36:Wear suitable protective clothing .
[RIDADR ]

3276
[WGK Germany ]

3
[Hazard Note ]

Toxic
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29269090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

2,3,4,6-Tetrafluorobenzonitrile-->Fluorobenzene
[Preparation Products]

Benzonitrile, 2,3,6-trichloro-
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,3,6-Trifluorobenzonitrile(136514-17-5).msds
Questions And AnswerBack Directory
[Application]

2,3,6-Trifluorobenzonitrile is often used as an important intermediate in organic synthesis. By transforming the fluorine atoms on its benzene ring, a variety of organic molecules with specific structures and functions can be synthesized. Furthermore, it has some applications in the field of materials science, specifically in the structural modification of liquid crystal materials.
Spectrum DetailBack Directory
[Spectrum Detail]

2,3,6-Trifluorobenzonitrile(136514-17-5)1HNMR
2,3,6-Trifluorobenzonitrile(136514-17-5)IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2,3,6-Trifluorobenzonitrile, 98%(136514-17-5)
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