2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one
TL;DR: 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one (CAS 149169-71-1) is a chemical compound with molecular formula C10H9BrF2O3 and molecular weight 293.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethanone
Also Known As: 2-bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one, 2-bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethanone, 2-bromo-1-[4-(difluoromethoxy)-3-methoxy-phenyl]ethanone
| Molecular Formula | C10H9BrF2O3 |
|---|---|
| Molecular Weight | 293.97 g/mol |
| LogP | 2.8742 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.9703 |
| Heavy Atoms | 16 |
| Complexity | 382.32693 |
Chemical Identifiers
| CAS Number | 149169-71-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=O)CBr)OC(F)F |
Product Overview
2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one (CAS 149169-71-1), with molecular formula C10H9BrF2O3 and molecular weight 293.97 g/mol. IUPAC: 2-bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethanone.
Chemical Property Profile of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one
Property Insights of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one
The XLogP value of 2.8742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one. With a topological polar surface area (TPSA) of 35.53 Ų, 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one has 0 hydrogen bond donor(s) and 3 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 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one?
The CAS number of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one is 149169-71-1.
What is the molecular formula of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one?
The molecular formula of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one is C10H9BrF2O3.
What is the molecular weight of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one?
The molecular weight of 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one is 293.97 g/mol.
Where can I buy 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one?
You can request a quote for 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1-[4-(difluoromethoxy)-3-methoxyphenyl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.