Ethyl 3-(3-fluorophenyl)prop-2-enoate
TL;DR: Ethyl 3-(3-fluorophenyl)prop-2-enoate (CAS 166250-00-6) is a chemical compound with molecular formula C11H11FO2 and molecular weight 194.07431 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-(3-fluorophenyl)prop-2-enoate
Also Known As: Ethyl 3-(3-fluorophenyl)acrylate, Ethyl 3-fluorocinnamate, ethyl 3-(3-fluorophenyl)prop-2-enoate, ethyl (E)-3-(3-fluorophenyl)acrylate, Ethyl 3-(3-fluorophenyl)-2-propenoate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H11FO2 |
| Molecular Weight | 194.07431 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.07431 Da |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
| SMILES | CCOC(=O)C=CC1=CC(=CC=C1)F |
| InChIKey | LXHLBKGIOOFCAR-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3-(3-fluorophenyl)prop-2-enoate
Property Insights of Ethyl 3-(3-fluorophenyl)prop-2-enoate
The XLogP value of 3.1 indicates that Ethyl 3-(3-fluorophenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 3-(3-fluorophenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(3-fluorophenyl)prop-2-enoate 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
What is the CAS number of Ethyl 3-(3-fluorophenyl)prop-2-enoate?
The CAS number of Ethyl 3-(3-fluorophenyl)prop-2-enoate is 166250-00-6.
What is the molecular formula of Ethyl 3-(3-fluorophenyl)prop-2-enoate?
The molecular formula of Ethyl 3-(3-fluorophenyl)prop-2-enoate is C11H11FO2.
What is the molecular weight of Ethyl 3-(3-fluorophenyl)prop-2-enoate?
The molecular weight of Ethyl 3-(3-fluorophenyl)prop-2-enoate is 194.07431 g/mol.
Where can I buy Ethyl 3-(3-fluorophenyl)prop-2-enoate?
You can request a quote for Ethyl 3-(3-fluorophenyl)prop-2-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3-(3-fluorophenyl)prop-2-enoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3-(3-fluorophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.