![3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid structure](/static/products/7232/723246-95-5.webp)
3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid
TL;DR: 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid (CAS 723246-95-5) is a chemical compound with molecular formula C17H14ClFO4 and molecular weight 336.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]prop-2-enoic acid
Also Known As: AH-487/42918744, 3-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid, 3-[3-Chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]-2-propenoic acid, (2E)-3-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}prop-2-enoic acid, (E)-3-[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]prop-2-enoic acid
| Molecular Formula | C17H14ClFO4 |
|---|---|
| Molecular Weight | 336.06 g/mol |
| LogP | 4.1645 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.05646 |
| Heavy Atoms | 23 |
| Complexity | 726.1184 |
Chemical Identifiers
| CAS Number | 723246-95-5 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=C/C(=O)O)Cl)OCC2=CC=C(C=C2)F |
Product Overview
3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid (CAS 723246-95-5), with molecular formula C17H14ClFO4 and molecular weight 336.06 g/mol. IUPAC: (E)-3-[3-chloro-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]prop-2-enoic acid.
Chemical Property Profile of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid
Property Insights of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid
The XLogP value of 4.1645 indicates that 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid has 1 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 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid?
The CAS number of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid is 723246-95-5.
What is the molecular formula of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid?
The molecular formula of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid is C17H14ClFO4.
What is the molecular weight of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid?
The molecular weight of 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid is 336.06 g/mol.
Where can I buy 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid?
You can request a quote for 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{3-Chloro-4-[(4-fluorobenzyl)oxy]-5-methoxyphenyl}acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.