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219371

Sigma-Aldrich

3-Fluorobenzotrifluoride

99%

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Synonym(s):
α,α,α,3-Tetrafluorotoluene
Linear Formula:
FC6H4CF3
CAS Number:
Molecular Weight:
164.10
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

99%

form

liquid

refractive index

n20/D 1.4 (lit.)

bp

101-102 °C (lit.)

density

1.302 g/mL at 25 °C (lit.)

SMILES string

Fc1cccc(c1)C(F)(F)F

InChI

1S/C7H4F4/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H

InChI key

GBOWGKOVMBDPJF-UHFFFAOYSA-N

Application

3-Fluorobenzotrifluoride was used:
  • as fluorinated aromatic solvent to investigate electrogenerated chemiluminescence of 9,10-diphenylanthracene, rubrene and anthracene
  • used to preparae 2-nitro-5-fluorobenzotrifluoride via nitration reaction

Pictograms

FlameExclamation mark

Signal Word

Danger

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

closed cup

Flash Point(C)

closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

Certificates of Analysis (COA)

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Aromatic Fluorine Compounds. I. The Synthesis of 2, 5-and 3, 5-Difluorobenzotrifluorides1.
Finger GC and Reed FH.
Journal of the American Chemical Society, 66(11), 1972-1974 (1944)
David J Vinyard et al.
The journal of physical chemistry. A, 112(37), 8529-8533 (2008-08-30)
The electrogenerated chemiluminescence (ECL) of 9,10-diphenylanthracene (DPA), rubrene, and anthracene has been studied in fluorinated aromatic solvents. Mixed annihilation ECL between aromatic luminophores and quinones was observed in solvent systems containing acetonitrile and either benzene, benzotrifluoride, 3-fluorobenzotrifluoride, or 1,3-bis(trifluoromethyl)benzene. Increases

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