Dimethyl 4-methoxy benzylidene malonate
Product Information
Molecular Formula
C13H14O5
Molecular Weight
250.24726
Description
Dimethyl 4-methoxy benzylidene malonate is a widely studied chemical compound in the biomedical sector, exhibits tremendous potential as a therapeutic agent for managing diverse ailments. Research indicates that its application in drug development, targeting precise enzymes or receptors implicated in cancer, inflammation, and neurological disorders, holds significant prospects. This compound, owing to its inherent properties, offers a promising avenue for addressing multifarious maladies persisting in the human body.
Synonyms
dimethyl (p-methoxybenzylidene)malonate; Propanedioic acid, (4-methoxyphenyl)methylene-, dimethyl ester; HOSTAVINPR-25; DIMETHYL(PARA-METHOXYBENZYLIDENE)MALONATE; 4-Methoxybenzylidene malonic acid dimethyl ester
IUPAC Name
dimethyl 2-[(4-methoxyphenyl)methylidene]propanedioate
SMILES
COC1=CC=C(C=C1)C=C(C(=O)OC)C(=O)OC
InChI
InChI=1S/C13H14O5/c1-16-10-6-4-9(5-7-10)8-11(12(14)17-2)13(15)18-3/h4-8H,1-3H3
InChI Key
JMFYZMAVUHNCPW-UHFFFAOYSA-N
Boiling Point
130 °C/0.04 mmHg
Melting Point
59 °C
Purity
>98.0%(GC)
Appearance
White to Almost white powder to crystal
Computed Properties
XLogP3
2.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
6
Exact Mass
250.08412354 g/mol
Monoisotopic Mass
250.08412354 g/mol
Topological Polar Surface Area
61.8Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
308
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-114058271-A | Adhesive film with different UV absorption wave bands and preparation method thereof | 2021-12-22 |
| JP-2021080483-A | Complex | 2021-03-04 |
| CN-112143155-A | Plastic additive and production process thereof | 2020-09-28 |
| WO-2022036044-A1 | Olefinic compositions comprising hydrocarbon resins | 2020-08-13 |
| WO-2022002787-A1 | Coatings from polyisocyanurate coatings (rim) and their use in injection molding processes | 2020-07-02 |
| WO-2021259825-A1 | Polymerisable liquid crystal material and polymerised liquid crystal film | 2020-06-23 |
| EP-3923064-A1 | Electrochromic solution | 2020-06-12 |
| WO-2021250114-A1 | Electrochromic solution | 2020-06-12 |
| JP-2021187863-A | Polycarbonate resin composition and its molded products | 2020-05-25 |
| WO-2021226430-A1 | Norbornene esters as comonomers for thermoset articles | 2020-05-07 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22985959 | 2012-10-15 | Selection, synthesis, and anti-inflammatory evaluation of the arylidene malonate derivatives as TLR4 signaling inhibitors | Bioorganic & medicinal chemistry |
| 5453 | 1976-05-25 | Affinity labeling of a previously undetected essential lysyl residue in class I fructose bisphosphate aldolase | The Journal of biological chemistry |
