3-(2,2,2-Trifluoroethoxy)benzaldehyde
TL;DR: 3-(2,2,2-Trifluoroethoxy)benzaldehyde (CAS 155908-58-0) is a chemical compound with molecular formula C9H7F3O2 and molecular weight 204.03981 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2,2,2-trifluoroethoxy)benzaldehyde
Also Known As: 3-(2,2,2-trifluoroethoxy)benzaldehyde, 3-(2,2,2-Trifluoroethoxy)-benzaldehyde, 3-(2,2,2-trifluoroethoxy) benzaldehyde, Benzaldehyde, 3-(2,2,2-trifluoroethoxy)-, 4893AD
Technical Specifications
| Molecular Formula | C9H7F3O2 |
| Molecular Weight | 204.03981 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.03981 Da |
| Heavy Atoms | 14 |
| Complexity | 191.0 |
| SMILES | C1=CC(=CC(=C1)OCC(F)(F)F)C=O |
| InChIKey | VXNUKVSIHDRZRA-UHFFFAOYSA-N |
Chemical Property Profile of 3-(2,2,2-Trifluoroethoxy)benzaldehyde
Property Insights of 3-(2,2,2-Trifluoroethoxy)benzaldehyde
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,2,2-Trifluoroethoxy)benzaldehyde. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(2,2,2-Trifluoroethoxy)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(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 3-(2,2,2-Trifluoroethoxy)benzaldehyde?
The CAS number of 3-(2,2,2-Trifluoroethoxy)benzaldehyde is 155908-58-0.
What is the molecular formula of 3-(2,2,2-Trifluoroethoxy)benzaldehyde?
The molecular formula of 3-(2,2,2-Trifluoroethoxy)benzaldehyde is C9H7F3O2.
What is the molecular weight of 3-(2,2,2-Trifluoroethoxy)benzaldehyde?
The molecular weight of 3-(2,2,2-Trifluoroethoxy)benzaldehyde is 204.03981 g/mol.
Where can I buy 3-(2,2,2-Trifluoroethoxy)benzaldehyde?
You can request a quote for 3-(2,2,2-Trifluoroethoxy)benzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(2,2,2-Trifluoroethoxy)benzaldehyde?
Yes, CoreyChem provides custom synthesis services for 3-(2,2,2-Trifluoroethoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.