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Safety Information

139416

Sigma-Aldrich

4-Fluorobenzonitrile

99%

Synonym(s):

1-Cyano-4-fluorobenzene, 4-Cyanofluorobenzene, 4-Fluorobenzonitrile, 4-Fluorocyanobenzene, Para-fluorobenzonitrile, p-Cyanofluorobenzene, p-Fluorobenzonitrile, p-Fluorophenyl cyanide

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About This Item

Linear Formula:
FC6H4CN
CAS Number:
1194-02-1
Molecular Weight:
121.11
Beilstein:
2041517
EC Number:
214-784-9
MDL number:
MFCD00001812
UNSPSC Code:
12352100
PubChem Substance ID:
24848410
NACRES:
NA.22

Quality Level

200

Assay

99%

form

solid

bp

188 °C/750 mmHg (lit.)

mp

32-34 °C (lit.)

functional group

fluoro
nitrile

SMILES string

Fc1ccc(cc1)C#N

InChI

1S/C7H4FN/c8-7-3-1-6(5-9)2-4-7/h1-4H

InChI key

AEKVBBNGWBBYLL-UHFFFAOYSA-N

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General description

4-Fluorobenzonitrile undergoes metal-mediated coupling to yield eight-membered thorium(IV) tetraazamacrocycle. It undergoes condensation with diphenylamine to yield monomer 4-cyanotriphenylamine.

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Danger

Hazard Statements

H228,H302 + H312 + H332

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Flam. Sol. 1

Storage Class Code

4.1B - Flammable solid hazardous materials

WGK

WGK 3

Flash Point(F)

149.0 °F - closed cup

Flash Point(C)

65 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Deleterious substance

JAN Code

139416-25G:4548173105130
139416-BULK:
139416-VAR:
139416-5G:4548173105147

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Certificates of Analysis (COA)

Lot/Batch Number
SDBB1597
STBL0552
STBK9276
STBK4199
STBJ8518

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Poly (triphenylamine) s derived from oxidative coupling reaction: Substituent effects on the polymerization, electrochemical, and electro-optical properties.
Lin H-Y and Liou G-S.
Journal of Polymer Science Part A: Polymer Chemistry, 47(1), 285-294 (2009)
Eric J Schelter et al.
Chemical communications (Cambridge, England), (10)(10), 1029-1031 (2007-02-28)
An eight-membered thorium(IV) tetraazamacrocycle is produced by the sequential, metal-mediated coupling of four equivalents of 4-fluorobenzonitrile; its formation is consistent with the involvement of an imido intermediate, generated from a thorium ketimide complex.
Soumya Mukherjee et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 24(45), 11771-11778 (2018-05-29)
Fluorous organic building blocks were utilized to develop two self-assembled, hydrophobic, fluorinated porous organic polymers (FPOPs), namely, FPOP-100 and FPOP-101. Comprehensive mechanical analyses of these functionalised triazine network polymers marked the introduction of mechanical stiffness among all porous organic network
Tryfon Zarganes-Tzitzikas et al.
Molecules (Basel, Switzerland), 24(7) (2019-04-17)
Imaging techniques, such as positron emission tomography (PET), represent great progress in the clinical development of drugs and diagnostics. However, the efficient and timely synthesis of appropriately labeled compounds is a largely unsolved problem. Numerous small drug-like molecules with high
Oriol Planas et al.
Science (New York, N.Y.), 367(6475), 313-317 (2020-01-18)
Bismuth catalysis has traditionally relied on the Lewis acidic properties of the element in a fixed oxidation state. In this paper, we report a series of bismuth complexes that can undergo oxidative addition, reductive elimination, and transmetallation in a manner

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