ethyl (E)-3-(2-fluorophenyl)prop-2-enoate
TL;DR: ethyl (E)-3-(2-fluorophenyl)prop-2-enoate (CAS 1379666-57-5) is a chemical compound with molecular formula C11H11FO2 and molecular weight 194.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-(2-fluorophenyl)prop-2-enoate
Also Known As: ethyl 2-fluorocinnamate, ethyl (E)-3-(2-fluorophenyl)prop-2-enoate, ethyl 3-(2-fluorophenyl)prop-2-enoate, (E)-Ethyl 3-(2-fluorophenyl)acrylate, Ethyl 2' -fluorocinnamate
| Molecular Formula | C11H11FO2 |
|---|---|
| Molecular Weight | 194.07 g/mol |
| LogP | 2.402 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.07431 |
| Heavy Atoms | 14 |
| Complexity | 344.8957 |
Chemical Identifiers
| CAS Number | 1379666-57-5 |
|---|---|
| SMILES | CCOC(=O)/C=C/C1=CC=CC=C1F |
Product Overview
ethyl (E)-3-(2-fluorophenyl)prop-2-enoate (CAS 1379666-57-5), with molecular formula C11H11FO2 and molecular weight 194.07 g/mol. IUPAC: ethyl (E)-3-(2-fluorophenyl)prop-2-enoate.
Chemical Property Profile of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate
Property Insights of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate
The XLogP value of 2.402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (E)-3-(2-fluorophenyl)prop-2-enoate. With a topological polar surface area (TPSA) of 26.3 Ų, ethyl (E)-3-(2-fluorophenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (E)-3-(2-fluorophenyl)prop-2-enoate has 0 hydrogen bond donor(s) and 2 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 ethyl (E)-3-(2-fluorophenyl)prop-2-enoate?
The CAS number of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate is 1379666-57-5.
What is the molecular formula of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate?
The molecular formula of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate is C11H11FO2.
What is the molecular weight of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate?
The molecular weight of ethyl (E)-3-(2-fluorophenyl)prop-2-enoate is 194.07 g/mol.
Where can I buy ethyl (E)-3-(2-fluorophenyl)prop-2-enoate?
You can request a quote for ethyl (E)-3-(2-fluorophenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (E)-3-(2-fluorophenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (E)-3-(2-fluorophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.