4-Fluorostyrene
Product Information
Molecular Formula
C8H7F
Molecular Weight
122.14
Description
4-Fluorostyrene is a widely utilized chemical compound in the biomedical sector, and occupies a pivotal position in the advancement of pharmaceutical agents targeting a multitude of ailments. Intricate investigations and comprehensive trials attest to the remarkable efficacy of 4-Fluorostyrene in combating formidable adversaries, including malignancies, viral afflictions, and neurodegenerative maladies.
Synonyms
4-FLUOROSTYRENE; P-FLUOROSTYRENE; 1-fluoro-4-ethenylbenzene; 1-Fluoro-4-vinylbenzene; para-Fluorostyrene; Styrene, p-fluoro-
IUPAC Name
1-ethenyl-4-fluorobenzene
SMILES
C=CC1=CC=C(C=C1)F
InChI
InChI=1S/C8H7F/c1-2-7-3-5-8(9)6-4-7/h2-6H,1H2
InChI Key
JWVTWJNGILGLAT-UHFFFAOYSA-N
Boiling Point
145-148°C
Melting Point
-3°C
Flash Point
95.0 °CF - closed cup
Purity
97%
Density
1.024
Appearance
Colorless liquid.
Storage
2-8°C
Refractive Index
n20/D 1.514 (lit.)
Safety Information
Hazards
H226:
Flammable liquid and vapour.
Flammable liquid and vapour.
Precautionary Statement
P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P233:
Keep container tightly closed.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P370+P378:
In case of fire:
Use for extinction:
P403+P235:
Store in a well ventilated place.
Keep cool.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P233:
Keep container tightly closed.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P370+P378:
In case of fire:
Use for extinction:
P403+P235:
Store in a well ventilated place.
Keep cool.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
2.8
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
1
Exact Mass
122.053178385 g/mol
Monoisotopic Mass
122.053178385 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
90.7
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114133675-A | Polystyrene foam material with good flame retardance and preparation process thereof | 2021-12-13 |
| CN-113862708-A | Method for electrochemically synthesizing beta-cyano-bis-phenylsulfonyl imide compound | 2021-11-03 |
| CN-114149300-A | Synthesis method of copper-catalyzed trifluoromethyl allene compound | 2021-11-01 |
| CN-113754601-A | Synthesis method of N2-beta-sulfanyl triazole derivative | 2021-10-25 |
| CN-113880873-A | Hydroboration reaction method for catalyzing olefin by calcium halide | 2021-10-25 |
| JP-2022009434-A | Plating diaphragm, plating method and plating equipment | 2021-10-22 |
| CN-113860984-A | Magnesium-activated ligand-promoted chromium-catalyzed polycyclic aromatic hydrocarbon and olefin regioselective hydrogenation method | 2021-10-09 |
| CN-113736002-A | Modified polyhalogenated styrene-1, 3-butadiene emulsion binder, preparation and application thereof | 2021-09-13 |
| CN-113620791-A | Method for preparing carbonyl compound by catalyzing oxidative fracture of olefin compound through visible light excited aqueous solution quantum dots | 2021-09-07 |
| CN-113582915-A | Synthesis method of 4-substituted pyridine compound | 2021-07-25 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22161809 | 2012-01-23 | Staining of fluid-catalytic-cracking catalysts: localising Brønsted acidity within a single catalyst particle | Chemistry (Weinheim an der Bergstrasse, Germany) |
| 22689404 | 2012-01-01 | Design, synthesis and cytotoxicity of novel 2-arylvinyl-4-aminoquinoline derivatives | Chemical & pharmaceutical bulletin |
| 20645346 | 2010-08-23 | Lithiated fluorinated styrene oxides: configurational stability, synthetic applications, and mechanistic insight | Chemistry (Weinheim an der Bergstrasse, Germany) |
| 20473417 | 2010-07-14 | Styrene oligomerization as a molecular probe reaction for zeolite acidity: a UV-Vis spectroscopy and DFT study | Physical chemistry chemical physics : PCCP |
| 18774785 | 2008-10-09 | Water complexes of styrene and 4-fluorostyrene: a combined electronic, vibrational spectroscopic and ab-initio investigation | The journal of physical chemistry. A |
| 18220391 | 2008-02-20 | Bimetallic effects in homopolymerization of styrene and copolymerization of ethylene and styrenic comonomers: scope, kinetics, and mechanism | Journal of the American Chemical Society |
| 18052133 | 2007-12-27 | Gas-phase electronic spectra of two substituted benzene cations: phenylacetylene+ and 4-fluorostyrene+ | The journal of physical chemistry. A |
| 17639525 | 2007-01-01 | Revealing shape selectivity and catalytic activity trends within the pores of H-ZSM-5 crystals by time- and space-resolved optical and fluorescence microspectroscopy | Chemistry (Weinheim an der Bergstrasse, Germany) |
| 16035762 | 2005-06-22 | High-resolution ultraviolet spectroscopy of p-fluorostyrene-water: evidence for a sigma-type hydrogen-bonded dimer | The Journal of chemical physics |
| 16833652 | 2005-04-14 | Impact of extended pi conjugation on methyl rotor-induced IVR in aromatic molecules | The journal of physical chemistry. A |
