3-(3,4-Dichlorophenoxy)benzaldehyde
TL;DR: 3-(3,4-Dichlorophenoxy)benzaldehyde (CAS 79124-76-8) is a chemical compound with molecular formula C13H8Cl2O2 and molecular weight 265.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dichlorophenoxy)benzaldehyde
Also Known As: 3-(3,4-Dichlorophenoxy)benzaldehyde, m-(3,4-Dichlorophenoxy)benzaldehyde, 3-(3,4-Dichlorophenoxy)-benzaldehyde, Benzaldehyde, 3-(3,4-dichlorophenoxy)-, 3-(3,4-Dichorophenoxy)benzaldehyde
| Molecular Formula | C13H8Cl2O2 |
|---|---|
| Molecular Weight | 265.99 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.99014 |
| Heavy Atoms | 17 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 79124-76-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=CC(=C(C=C2)Cl)Cl)C=O |
| InChIKey | ABQHJSHFFLAGHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3,4-Dichlorophenoxy)benzaldehyde (CAS 79124-76-8), with molecular formula C13H8Cl2O2 and molecular weight 265.99 g/mol. IUPAC: 3-(3,4-dichlorophenoxy)benzaldehyde.
Chemical Property Profile of 3-(3,4-Dichlorophenoxy)benzaldehyde
Property Insights of 3-(3,4-Dichlorophenoxy)benzaldehyde
The XLogP value of 4.2 indicates that 3-(3,4-Dichlorophenoxy)benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(3,4-Dichlorophenoxy)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-Dichlorophenoxy)benzaldehyde has 0 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 3-(3,4-Dichlorophenoxy)benzaldehyde?
The CAS number of 3-(3,4-Dichlorophenoxy)benzaldehyde is 79124-76-8.
What is the molecular formula of 3-(3,4-Dichlorophenoxy)benzaldehyde?
The molecular formula of 3-(3,4-Dichlorophenoxy)benzaldehyde is C13H8Cl2O2.
What is the molecular weight of 3-(3,4-Dichlorophenoxy)benzaldehyde?
The molecular weight of 3-(3,4-Dichlorophenoxy)benzaldehyde is 265.99 g/mol.
Where can I buy 3-(3,4-Dichlorophenoxy)benzaldehyde?
You can request a quote for 3-(3,4-Dichlorophenoxy)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-Dichlorophenoxy)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-Dichlorophenoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.