3-(3-(Trifluoromethyl)phenoxy)benzaldehyde
TL;DR: 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde (CAS 78725-46-9) is a chemical compound with molecular formula C14H9F3O2 and molecular weight 266.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(trifluoromethyl)phenoxy]benzaldehyde
Also Known As: 3-[3-(Trifluoromethyl)phenoxy]benzaldehyde, 3-(3-(TRIFLUOROMETHYL)PHENOXY)BENZALDEHYDE, 3-(3-Trifluoromethylphenoxy)benzaldehyde, RPORRWJOHNQOHN-UHFFFAOYSA-, EINECS 278-976-4
| Molecular Formula | C14H9F3O2 |
|---|---|
| Molecular Weight | 266.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.05545 |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 78725-46-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=CC=CC(=C2)C(F)(F)F)C=O |
| InChIKey | RPORRWJOHNQOHN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3-(Trifluoromethyl)phenoxy)benzaldehyde (CAS 78725-46-9), with molecular formula C14H9F3O2 and molecular weight 266.06 g/mol. IUPAC: 3-[3-(trifluoromethyl)phenoxy]benzaldehyde.
Chemical Property Profile of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde
Property Insights of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde
The XLogP value of 4.0 indicates that 3-(3-(Trifluoromethyl)phenoxy)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-(Trifluoromethyl)phenoxy)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde has 0 hydrogen bond donor(s) and 5 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-(Trifluoromethyl)phenoxy)benzaldehyde?
The CAS number of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde is 78725-46-9.
What is the molecular formula of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde?
The molecular formula of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde is C14H9F3O2.
What is the molecular weight of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde?
The molecular weight of 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde is 266.06 g/mol.
Where can I buy 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde?
You can request a quote for 3-(3-(Trifluoromethyl)phenoxy)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-(Trifluoromethyl)phenoxy)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-(Trifluoromethyl)phenoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.