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About This Item
Linear Formula:
C6F5CN
CAS Number:
Molecular Weight:
193.07
Beilstein:
1913453
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
99%
form
liquid
refractive index
n20/D 1.442 (lit.)
bp
162-164 °C (lit.)
density
1.532 g/mL at 25 °C (lit.)
functional group
fluoro
SMILES string
Fc1c(F)c(F)c(C#N)c(F)c1F
InChI
1S/C7F5N/c8-3-2(1-13)4(9)6(11)7(12)5(3)10
InChI key
YXWJGZQOGXGSSC-UHFFFAOYSA-N
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Application
2,3,4,5,6-Pentafluorobenzonitrile was used in the synthesis of novel fluorinated poly(ether nitrile)s. It was also used in the synthesis of pentafluorophenyl analogs of noradrenaline, adrenaline and N-methyladrenaline.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Flam. Liq. 3
Storage Class Code
3 - Flammable liquids
WGK
WGK 3
Flash Point(F)
84.2 °F - closed cup
Flash Point(C)
29 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Highly fluorinated analogues of pharmacologically active compounds.
Chapman NB, et al.
J. Chem. Soc. Sect. C, 293-296 (1967)
Synthesis of novel fluorine-containing poly (aryl ether nitrile) s derived from 2, 3, 4, 5, 6-pentafluorobenzonitrile.
Kimura K, et al.
Polymer Journal, 33(3), 290-296 (2001)
Justin D Smith et al.
Nature communications, 10(1), 1837-1837 (2019-04-25)
Photocatalytic polymers offer an alternative to prevailing organometallics and nanomaterials, and they may benefit from polymer-mediated catalytic and material enhancements. MPC-1, a polymer photoredox catalyst reported herein, exhibits enhanced catalytic activity arising from charge transfer states (CTSs) between its two
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