![{3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol structure](/static/products/6805/680587-55-7.webp)
{3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol
TL;DR: {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol (CAS 680587-55-7) is a chemical compound with molecular formula C17H19BrO3 and molecular weight 350.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methanol
Also Known As: {3-bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol, 3-Bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]benzenemethanol, [3-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methanol
| Molecular Formula | C17H19BrO3 |
|---|---|
| Molecular Weight | 350.05 g/mol |
| LogP | 4.22752 |
| Topological Polar Surface Area | 38.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.05176 |
| Heavy Atoms | 21 |
| Complexity | 610.9794 |
Chemical Identifiers
| CAS Number | 680587-55-7 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)CO)Br)OCC2=CC=CC(=C2)C |
Product Overview
{3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol (CAS 680587-55-7), with molecular formula C17H19BrO3 and molecular weight 350.05 g/mol. IUPAC: [3-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methanol.
Chemical Property Profile of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol
Property Insights of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol
The XLogP value of 4.22752 indicates that {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.69 Ų, {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol 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-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol?
The CAS number of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol is 680587-55-7.
What is the molecular formula of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol?
The molecular formula of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol is C17H19BrO3.
What is the molecular weight of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol?
The molecular weight of {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol is 350.05 g/mol.
Where can I buy {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol?
You can request a quote for {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol 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-methylbenzyl)oxy]phenyl}methanol?
Yes, KEHONG BIO provides custom synthesis services for {3-Bromo-5-ethoxy-4-[(3-methylbenzyl)oxy]phenyl}methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.