![1-Bromo-4-[chloro(difluoro)methoxy]benzene structure](/static/products/1125/112556-13-5.webp)
1-Bromo-4-[chloro(difluoro)methoxy]benzene
TL;DR: 1-Bromo-4-[chloro(difluoro)methoxy]benzene (CAS 112556-13-5) is a chemical compound with molecular formula C7H4BrClF2O and molecular weight 255.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-[chloro(difluoro)methoxy]benzene
Also Known As: 1-Bromo-4-[chloro(difluoro)methoxy]benzene, Benzene, 1-bromo-4-(chlorodifluoromethoxy)-, 4-Bromo(difluorochloromethoxy)benzene, Benzene, 1-bromo-4-chlorodifluoromethoxy-, Benzene,1-bromo-4-(chlorodifluoromethoxy)
| Molecular Formula | C7H4BrClF2O |
|---|---|
| Molecular Weight | 255.91 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.91022 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 112556-13-5 |
|---|---|
| SMILES | C1=CC(=CC=C1OC(F)(F)Cl)Br |
| InChIKey | QBFJZAGJDZAVQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-4-[chloro(difluoro)methoxy]benzene (CAS 112556-13-5), with molecular formula C7H4BrClF2O and molecular weight 255.91 g/mol. IUPAC: 1-bromo-4-[chloro(difluoro)methoxy]benzene.
Chemical Property Profile of 1-Bromo-4-[chloro(difluoro)methoxy]benzene
Property Insights of 1-Bromo-4-[chloro(difluoro)methoxy]benzene
The XLogP value of 4.0 indicates that 1-Bromo-4-[chloro(difluoro)methoxy]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Bromo-4-[chloro(difluoro)methoxy]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-4-[chloro(difluoro)methoxy]benzene 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 1-Bromo-4-[chloro(difluoro)methoxy]benzene?
The CAS number of 1-Bromo-4-[chloro(difluoro)methoxy]benzene is 112556-13-5.
What is the molecular formula of 1-Bromo-4-[chloro(difluoro)methoxy]benzene?
The molecular formula of 1-Bromo-4-[chloro(difluoro)methoxy]benzene is C7H4BrClF2O.
What is the molecular weight of 1-Bromo-4-[chloro(difluoro)methoxy]benzene?
The molecular weight of 1-Bromo-4-[chloro(difluoro)methoxy]benzene is 255.91 g/mol.
Where can I buy 1-Bromo-4-[chloro(difluoro)methoxy]benzene?
You can request a quote for 1-Bromo-4-[chloro(difluoro)methoxy]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-4-[chloro(difluoro)methoxy]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-4-[chloro(difluoro)methoxy]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.