3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde
TL;DR: 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde (CAS 792945-89-2) is a chemical compound with molecular formula C16H14BrFO3 and molecular weight 352.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-ethoxy-4-[(3-fluorophenyl)methoxy]benzaldehyde
Also Known As: 3-bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde, 3-bromo-5-ethoxy-4-[(3-fluorophenyl)methoxy]benzaldehyde
| Molecular Formula | C16H14BrFO3 |
|---|---|
| Molecular Weight | 352.01 g/mol |
| LogP | 4.3784 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 352.01105 |
| Heavy Atoms | 21 |
| Complexity | 643.41437 |
Chemical Identifiers
| CAS Number | 792945-89-2 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=O)Br)OCC2=CC(=CC=C2)F |
Product Overview
3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde (CAS 792945-89-2), with molecular formula C16H14BrFO3 and molecular weight 352.01 g/mol. IUPAC: 3-bromo-5-ethoxy-4-[(3-fluorophenyl)methoxy]benzaldehyde.
Chemical Property Profile of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde
Property Insights of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde
The XLogP value of 4.3784 indicates that 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde 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
Frequently Asked Questions
What is the CAS number of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde?
The CAS number of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde is 792945-89-2.
What is the molecular formula of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde?
The molecular formula of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde is C16H14BrFO3.
What is the molecular weight of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde?
The molecular weight of 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde is 352.01 g/mol.
Where can I buy 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde?
You can request a quote for 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-5-ethoxy-4-[(3-fluorobenzyl)oxy]benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.