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4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde
TL;DR: 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde (CAS 428490-81-7) is a chemical compound with molecular formula C15H12BrClO3 and molecular weight 353.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxybenzaldehyde
Also Known As: 4-[(4-bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde, 4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxybenzaldehyde, 4-((4-Bromobenzyl)oxy)-3-chloro-5-methoxybenzaldehyde, 4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxy-benzaldehyde, Cambridge id 6484127
| Molecular Formula | C15H12BrClO3 |
|---|---|
| Molecular Weight | 353.97 g/mol |
| LogP | 4.5026 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.96582 |
| Heavy Atoms | 20 |
| Complexity | 611.26086 |
Chemical Identifiers
| CAS Number | 428490-81-7 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=O)Cl)OCC2=CC=C(C=C2)Br |
Product Overview
4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde (CAS 428490-81-7), with molecular formula C15H12BrClO3 and molecular weight 353.97 g/mol. IUPAC: 4-[(4-bromophenyl)methoxy]-3-chloro-5-methoxybenzaldehyde.
Chemical Property Profile of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde
Property Insights of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde
The XLogP value of 4.5026 indicates that 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde 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 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde?
The CAS number of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde is 428490-81-7.
What is the molecular formula of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde?
The molecular formula of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde is C15H12BrClO3.
What is the molecular weight of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde?
The molecular weight of 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde is 353.97 g/mol.
Where can I buy 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde?
You can request a quote for 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Bromobenzyl)oxy]-3-chloro-5-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.