![1-[2-(Difluoromethoxy)phenyl]ethan-1-one structure](/static/products/1278/127842-55-1.webp)
1-[2-(Difluoromethoxy)phenyl]ethan-1-one
TL;DR: 1-[2-(Difluoromethoxy)phenyl]ethan-1-one (CAS 127842-55-1) is a chemical compound with molecular formula C9H8F2O2 and molecular weight 186.04924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(difluoromethoxy)phenyl]ethanone
Also Known As: 2'-(Difluoromethoxy)acetophenone, 1-(2-(Difluoromethoxy)phenyl)ethanone, 1-[2-(difluoromethoxy)phenyl]ethanone, 1-[2-(Difluoromethoxy)phenyl]ethan-1-one, Ethanone, 1-[2-(difluoromethoxy)phenyl]-
Technical Specifications
| Molecular Formula | C9H8F2O2 |
| Molecular Weight | 186.04924 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.04924 Da |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
| SMILES | CC(=O)C1=CC=CC=C1OC(F)F |
| InChIKey | GSIJRMUIVJNUGP-UHFFFAOYSA-N |
Chemical Property Profile of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one
Property Insights of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(Difluoromethoxy)phenyl]ethan-1-one. With a topological polar surface area (TPSA) of 26.3 Ų, 1-[2-(Difluoromethoxy)phenyl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(Difluoromethoxy)phenyl]ethan-1-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one?
The CAS number of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one is 127842-55-1.
What is the molecular formula of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one?
The molecular formula of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one is C9H8F2O2.
What is the molecular weight of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one?
The molecular weight of 1-[2-(Difluoromethoxy)phenyl]ethan-1-one is 186.04924 g/mol.
Where can I buy 1-[2-(Difluoromethoxy)phenyl]ethan-1-one?
You can request a quote for 1-[2-(Difluoromethoxy)phenyl]ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[2-(Difluoromethoxy)phenyl]ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 1-[2-(Difluoromethoxy)phenyl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.