4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde
TL;DR: 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde (CAS 876708-52-0) is a chemical compound with molecular formula C15H9F5O3 and molecular weight 332.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)methyl]benzaldehyde
Also Known As: 4-methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde, 4-Methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)methyl]benzaldehyde, 4-methoxy-3-[(pentafluorophenoxy)methyl]-benzaldehyde, 4-Methoxy-3-((perfluorophenoxy)methyl)benzaldehyde, 4-Methoxy-3-pentafluorophenyloxymethyl-benzaldehyde
| Molecular Formula | C15H9F5O3 |
|---|---|
| Molecular Weight | 332.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.04718 |
| Heavy Atoms | 23 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 876708-52-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=O)COC2=C(C(=C(C(=C2F)F)F)F)F |
| InChIKey | CKMVTIRWAOEGMF-UHFFFAOYSA-N |
Product Overview
4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde (CAS 876708-52-0), with molecular formula C15H9F5O3 and molecular weight 332.05 g/mol. IUPAC: 4-methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)methyl]benzaldehyde.
Chemical Property Profile of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde
Property Insights of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde
The XLogP value of 3.3 indicates that 4-Methoxy-3-[(pentafluorophenoxy)methyl]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, 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde has 0 hydrogen bond donor(s) and 8 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-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde?
The CAS number of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde is 876708-52-0.
What is the molecular formula of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde?
The molecular formula of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde is C15H9F5O3.
What is the molecular weight of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde?
The molecular weight of 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde is 332.05 g/mol.
Where can I buy 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde?
You can request a quote for 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-[(pentafluorophenoxy)methyl]benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.