![3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid structure](/static/products/4497/449778-67-0.webp)
3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid
TL;DR: 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid (CAS 449778-67-0) is a chemical compound with molecular formula C15H10ClFO3 and molecular weight 292.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid
Also Known As: 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]acrylic acid, 3-[2-(4-chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid, trans-2-(4-Chloro-3-fluorophenoxy)cinnamic acid, 3-[2-(4-chloro-3-fluoro-phenoxy)phenyl]prop-2-enoic Acid, 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]-2-propenoic acid
| Molecular Formula | C15H10ClFO3 |
|---|---|
| Molecular Weight | 292.03 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.03024 |
| Heavy Atoms | 20 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 449778-67-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC(=O)O)OC2=CC(=C(C=C2)Cl)F |
| InChIKey | MUBWGYNEVHIYJB-UHFFFAOYSA-N |
Product Overview
3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid (CAS 449778-67-0), with molecular formula C15H10ClFO3 and molecular weight 292.03 g/mol. IUPAC: 3-[2-(4-chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid.
Chemical Property Profile of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid
Property Insights of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid
The XLogP value of 4.1 indicates that 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid has 1 hydrogen bond donor(s) and 4 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 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid?
The CAS number of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid is 449778-67-0.
What is the molecular formula of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid?
The molecular formula of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid is C15H10ClFO3.
What is the molecular weight of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid?
The molecular weight of 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid is 292.03 g/mol.
Where can I buy 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid?
You can request a quote for 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-Chloro-3-fluorophenoxy)phenyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.