Ethyl-2,4,5-trifluorobenzoylacetate

Product Information

Molecular Formula:
C8H6F2
Molecular Weight:
140.13
Description
Ethyl-2,4,5-trifluorobenzoylacetate is a multifaceted compound prominently employed in the biomedical sector. Its inherent capacity to impede select enzymes participating in inflammation pathways endows it with promising anti-inflammatory traits, contributing to its potential application in alleviating various inflammatory ailments like rheumatoid arthritis and chronic obstructive pulmonary disease (COPD).
Synonyms
2,6-DIFLUOROSTYRENE; Benzene, 2-ethenyl-1,3-difluoro- (9CI)
IUPAC Name
2-ethenyl-1,3-difluorobenzene
Canonical SMILES
C=CC1=C(C=CC=C1F)F
InChI
InChI=1S/C8H6F2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H2
InChI Key
SFHOANYKPCNYMB-UHFFFAOYSA-N
Boiling Point
59ºC51 mm Hg(lit.)
Flash Point
87.8 ℃F - closed cup
Purity
95%
Density
1.13
Refractive Index
n20/D 1.499 (lit.)

Safety Information

Hazards
H226

Computed Properties

XLogP3
2.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
140.04375652 g/mol
Monoisotopic Mass
140.04375652 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
112
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-113136001-A Preparation method of ethylene-fluorostyrene copolymer 2021-04-23
CN-112961019-A Method for simply, conveniently and efficiently synthesizing aromatic olefin derivative 2021-02-19
CN-111978455-A Hydrophobic fluorine modified acrylic emulsion and preparation method and application thereof 2020-09-21
WO-2022046560-A1 Fluorescent dye loaded polymeric taggants for depth determination in drilling wells 2020-08-24
JP-2022029023-A Creation of functional composite fine particles using a gradient type polymer surfactant and a liquid drying method in combination 2020-08-04
JP-2022029024-A Creation of functional composite fine particles using a combination of an end-mixed block-type polymer surfactant and an in-liquid drying method 2020-08-04
JP-2022029025-A Creation of functional composite fine particles using a polymer surfactant synthesized by precision polymerization and an in-liquid drying method in combination. 2020-08-04
WO-2021257518-A1 Fluorosilicone polymers, compositions, and uses thereof 2020-06-15
WO-2021231362-A1 Thermoplastic elastomer compositions for use in pharmaceutical articles 2020-05-12
CN-113185509-A Compound containing indole ring structure, preparation method and application thereof, and bactericide 2020-04-17
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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