3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde
TL;DR: 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde (CAS 351066-31-4) is a chemical compound with molecular formula C16H15BrO3 and molecular weight 334.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]benzaldehyde
Also Known As: starbld0036434, 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde, 3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]benzaldehyde, 3-Bromo-5-methoxy-4-((4-methylbenzyl)oxy)benzaldehyde, 3-bromo-5-methoxy-4-(p-tolylmethoxy)benzaldehyde
| Molecular Formula | C16H15BrO3 |
|---|---|
| Molecular Weight | 334.02 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.02045 |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 351066-31-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C=O)OC |
| InChIKey | CQDHMSQODPWJCK-UHFFFAOYSA-N |
Product Overview
3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde (CAS 351066-31-4), with molecular formula C16H15BrO3 and molecular weight 334.02 g/mol. IUPAC: 3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]benzaldehyde.
Chemical Property Profile of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde
Property Insights of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde
The XLogP value of 3.9 indicates that 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-5-methoxy-4-[(4-methylbenzyl)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-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde?
The CAS number of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde is 351066-31-4.
What is the molecular formula of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde?
The molecular formula of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde is C16H15BrO3.
What is the molecular weight of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde?
The molecular weight of 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde is 334.02 g/mol.
Where can I buy 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde?
You can request a quote for 3-Bromo-5-methoxy-4-[(4-methylbenzyl)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-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.