![2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid structure](/static/products/6342/6342-88-7.webp)
2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid
TL;DR: 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid (CAS 6342-88-7) is a chemical compound with molecular formula C13H12O5 and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid
Also Known As: 3-(4-Methoxyphenyl)-2-propenylidenemalonic acid, 2-[3-(4-Methoxyphenyl)-2-propenylidene]malonic acid, 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid, 2-[3-(4-methoxyphenyl)prop-2-en-1-ylidene]propanedioic acid, [(2E)-3-(4-Methoxyphenyl)prop-2-en-1-ylidene]propanedioic acid
| Molecular Formula | C13H12O5 |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 1.804 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.06847 |
| Heavy Atoms | 18 |
| Complexity | 480.61783 |
Chemical Identifiers
| CAS Number | 6342-88-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/C=C(C(=O)O)C(=O)O |
Product Overview
2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid (CAS 6342-88-7), with molecular formula C13H12O5 and molecular weight 248.07 g/mol. IUPAC: 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid.
Chemical Property Profile of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid
Property Insights of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid
The XLogP value of 1.804 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid. Following Lipinski's Rule of Five, 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid?
The CAS number of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid is 6342-88-7.
What is the molecular formula of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid?
The molecular formula of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid is C13H12O5.
What is the molecular weight of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid?
The molecular weight of 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid is 248.07 g/mol.
Where can I buy 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid?
You can request a quote for 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-3-(4-methoxyphenyl)prop-2-enylidene]propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.