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Ethyl ferulate

CAT: 0013-GTR19171608-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19171608-01Size:500 mg
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Description
Ethyl ferulate is the ethyl ester of ferulic acid, a natural phenolic compound. It exhibits antioxidant, anti-inflammatory, and neuroprotective properties, making it a useful research tool for in vitro and in vivo studies in neuroscience, inflammation, and oncology.
CAS Number
4046-02-0
Product Name Alternative
Inhibit, Inhibitor, Ferulic acid ethyl ester, Ethyl 3- (4-hydroxy-3-methoxyphenyl) acrylate, Ethyl 4'-hydroxy-3'-methoxycinnamate, Ethyl ferulate, ReactiveOxygenSpecies, Reactive Oxygen Species
Field of Research
Immunology & Inflammation, Metabolism Research, Signal Transduction
Purity
99.39% (May vary between batches)
Solubility
DMSO:55 mg/mL (247.48 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (9 mM)
Smiles
C (=CC (OCC) =O) C1=CC (OC) =C (O) C=C1
Molecular Formula
C12H14O4
Molecular Weight
222.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ethyl Ferulate

ethyl ferulate has been reported in Coptis japonica, Solanum nigrum, and other organisms with data available.

CAS Number4046-02-0
PubChem CID736681
IUPAC Nameethyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Molecular FormulaC12H14O4
Molecular Weight222.24
XLogP2.2
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count16
Formal Charge0
Complexity249
SMILES
CCOC(=O)/C=C/C1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C12H14O4/c1-3-16-12(14)7-5-9-4-6-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3/b7-5+
InChIKey
ATJVZXXHKSYELS-FNORWQNLSA-N
Chemical Structure
2D Structure
2D structure of Ethyl Ferulate
CAS: 4046-02-0
CID: 736681
Formula: C12H14O4
MW: 222.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight222.24
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass222.08920892
Monoisotopic Mass222.08920892
Topological Polar Surface Area55.8 Ų
Heavy Atom Count16
Formal Charge0
Complexity249
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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