4-Bromo-2,5-difluoroanisole
TL;DR: 4-Bromo-2,5-difluoroanisole (CAS 79538-02-6) is a chemical compound with molecular formula C7H5BrF2O and molecular weight 221.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2,5-difluoro-4-methoxybenzene
Also Known As: 4-Bromo-2,5-difluoroanisole, 1-Bromo-2,5-difluoro-4-methoxybenzene, 4-Bromo-2,6-difluoroanisole, 2,5-Difluoro-4-bromoanisole, Benzene, 1-bromo-2,5-difluoro-4-methoxy-
| Molecular Formula | C7H5BrF2O |
|---|---|
| Molecular Weight | 221.95 g/mol |
| LogP | 2.7359 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.94917 |
| Heavy Atoms | 11 |
| Complexity | 275.38824 |
Chemical Identifiers
| CAS Number | 79538-02-6 |
|---|---|
| SMILES | COC1=CC(=C(C=C1F)Br)F |
Product Overview
4-Bromo-2,5-difluoroanisole (CAS 79538-02-6), with molecular formula C7H5BrF2O and molecular weight 221.95 g/mol. IUPAC: 1-bromo-2,5-difluoro-4-methoxybenzene.
Chemical Property Profile of 4-Bromo-2,5-difluoroanisole
Property Insights of 4-Bromo-2,5-difluoroanisole
The XLogP value of 2.7359 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2,5-difluoroanisole. With a topological polar surface area (TPSA) of 9.23 Ų, 4-Bromo-2,5-difluoroanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2,5-difluoroanisole has 0 hydrogen bond donor(s) and 1 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 4-Bromo-2,5-difluoroanisole?
The CAS number of 4-Bromo-2,5-difluoroanisole is 79538-02-6.
What is the molecular formula of 4-Bromo-2,5-difluoroanisole?
The molecular formula of 4-Bromo-2,5-difluoroanisole is C7H5BrF2O.
What is the molecular weight of 4-Bromo-2,5-difluoroanisole?
The molecular weight of 4-Bromo-2,5-difluoroanisole is 221.95 g/mol.
Where can I buy 4-Bromo-2,5-difluoroanisole?
You can request a quote for 4-Bromo-2,5-difluoroanisole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2,5-difluoroanisole?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2,5-difluoroanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.