5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde
TL;DR: 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde (CAS 145742-44-5) is a chemical compound with molecular formula C9H6ClF3O2 and molecular weight 238.00084 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde
Also Known As: 5-chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde, 2-(2,2,2-trifluoroethoxy)-5-chlorobenzaldehyde, 5-chloro-2-(2.2.2-trifluoroethoxy)benzaldehyde, 5-Chloro-2-(2,2,2-trifluoro-ethoxy)-benzaldehyde, A1-23833
Technical Specifications
| Molecular Formula | C9H6ClF3O2 |
| Molecular Weight | 238.00084 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.00084 Da |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
| SMILES | C1=CC(=C(C=C1Cl)C=O)OCC(F)(F)F |
| InChIKey | URTDPCPJQZOHTO-UHFFFAOYSA-N |
Chemical Property Profile of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde
Property Insights of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde
The XLogP value of 3.1 indicates that 5-Chloro-2-(2,2,2-trifluoroethoxy)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, 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-(2,2,2-trifluoroethoxy)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
What is the CAS number of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde?
The CAS number of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde is 145742-44-5.
What is the molecular formula of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde?
The molecular formula of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde is C9H6ClF3O2.
What is the molecular weight of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde?
The molecular weight of 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde is 238.00084 g/mol.
Where can I buy 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde?
You can request a quote for 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde?
Yes, CoreyChem provides custom synthesis services for 5-Chloro-2-(2,2,2-trifluoroethoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.