(E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester
TL;DR: (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester (CAS 26927-87-7) is a chemical compound with molecular formula C12H13FO3 and molecular weight 224.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-2-fluoro-3-(4-methoxyphenyl)prop-2-enoate
Also Known As: (E)-ethyl 2-fluoro-3-(4-methoxyphenyl)-2-propenoate, alpha-Fluoro-4-methoxy-cis-cinnamic acid ethyl ester, ethyl (E)-2-fluoro-3-(4-methoxyphenyl)prop-2-enoate, ethyl (2E)-2-fluoro-3-(4-methoxyphenyl)prop-2-enoate, Ethyl (2E)-2-fluoro-3-(4-methoxyphenyl)-2-propenoate #
| Molecular Formula | C12H13FO3 |
|---|---|
| Molecular Weight | 224.08 g/mol |
| LogP | 2.5687 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.08487 |
| Heavy Atoms | 16 |
| Complexity | 381.75528 |
Chemical Identifiers
| CAS Number | 26927-87-7 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C1=CC=C(C=C1)OC)/F |
Product Overview
(E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester (CAS 26927-87-7), with molecular formula C12H13FO3 and molecular weight 224.08 g/mol. IUPAC: ethyl (E)-2-fluoro-3-(4-methoxyphenyl)prop-2-enoate.
Chemical Property Profile of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester
Property Insights of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester
The XLogP value of 2.5687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester. With a topological polar surface area (TPSA) of 35.53 Ų, (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester has 0 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 (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester?
The CAS number of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester is 26927-87-7.
What is the molecular formula of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester?
The molecular formula of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester is C12H13FO3.
What is the molecular weight of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester?
The molecular weight of (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester is 224.08 g/mol.
Where can I buy (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester?
You can request a quote for (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-Fluoro-3-(4-methoxyphenyl)-propenoic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.