Tetrafluorohydroquinone

Product Information

Molecular Formula:
C6H2F4O2
Molecular Weight:
182.07
Description
Tetrafluorohydroquinone is a ubiquitous chemical compound extensively employed in the realm of biomedicine. It assumes a paramount position in the drug development of a myriad of afflictions, encompassing cancer and neurological disorders. By virtue of its formidable attributes as an antioxidant, this potent compound actively facilitates the generation of reactive oxygen species, thereby contributing significantly to the annihilation of malignant cells.
Synonyms
2,3,5,6-Tetrafluorobenzene-1,4-diol,2,3,5,6-Tetrafluorohydroquinone,Tetrafluoro-1,4-dihydroquinone
IUPAC Name
2,3,5,6-tetrafluorobenzene-1,4-diol
Canonical SMILES
C1(=C(C(=C(C(=C1F)F)O)F)F)O
InChI
InChI=1S/C6H2F4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11/h11-12H
InChI Key
ZSDAMBJDFDRLSS-UHFFFAOYSA-N
Boiling Point
205.5ºC at 760 mmHg
Melting Point
172-174ºC(lit.)
Flash Point
78℃
Purity
95%
Density
1.765 g/cm3
Appearance
SLIGHTLY BEIGE CRYSTALLINE POWDER

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3
2.8
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
0
Exact Mass
181.99909195 g/mol
Monoisotopic Mass
181.99909195 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
134
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-113831523-A Low dielectric constant and low dielectric loss liquid crystal polyarylester and composition and film thereof 2021-11-02
CN-113234193-A Self-supporting liquid crystal film and preparation method thereof 2021-05-20
CN-112375010-A Novel diamine, polyimide and polyimide film 2020-09-27
CN-111825525-A Preparation method of tetrafluoro-p-phenylene glycol capable of reducing waste emission 2020-08-18
WO-2022024073-A1 Glass containing flame retardant polycarbonate compositions 2020-07-30
WO-2022000270-A1 Thermoplastic compositions with improved hydrolytic and heat stability 2020-06-30
WO-2022003594-A1 Chemically-resistant flame retardant compositions 2020-06-30
WO-2022003600-A1 Scratch-resistant high impact strength pmma compositions 2020-06-30
JP-2022008153-A Method for Producing Carboxylate, Carboxylic Acid Generator, Resist Composition and Resist Pattern 2020-06-25
US-2021403708-A1 Fiber-Reinforced Polymer Composition 2020-06-25

Literatures

PMID Publication Date Title Journal
20603565 2010-07-01 Cocrystals of 2,3,5,6-tetrafluorobenzene-1,4-diol with diaza aromatic compounds Acta crystallographica. Section C, Crystal structure communications
17665374 2007-01-01 Selective inclusion of electron-donating molecules into porphyrin nanochannels derived from the self-assembly of saddle-distorted, protonated porphyrins and photoinduced electron transfer from guest molecules to porphyrin dications Chemistry (Weinheim an der Bergstrasse, Germany)
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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