![(2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid structure](/static/products/102/1024776-15-5.png)
(2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid
TL;DR: (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid (CAS 1024776-15-5) is a chemical compound with molecular formula C16H12BrFO3 and molecular weight 350.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]prop-2-enoic acid
Also Known As: (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid, 3-[3-Bromo-4-[(3-fluorophenyl)methoxy]phenyl]-2-propenoic acid
| Molecular Formula | C16H12BrFO3 |
|---|---|
| Molecular Weight | 350.00 g/mol |
| LogP | 4.265 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.9954 |
| Heavy Atoms | 21 |
| Complexity | 682.97235 |
Chemical Identifiers
| CAS Number | 1024776-15-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)/C=C/C(=O)O)Br |
Product Overview
(2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid (CAS 1024776-15-5), with molecular formula C16H12BrFO3 and molecular weight 350.00 g/mol. IUPAC: (E)-3-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]prop-2-enoic acid.
Chemical Property Profile of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid
Property Insights of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid
The XLogP value of 4.265 indicates that (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid has 1 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 (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid?
The CAS number of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid is 1024776-15-5.
What is the molecular formula of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid?
The molecular formula of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid is C16H12BrFO3.
What is the molecular weight of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid?
The molecular weight of (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid is 350.00 g/mol.
Where can I buy (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid?
You can request a quote for (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-{3-bromo-4-[(3-fluorobenzyl)oxy]phenyl}acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.