1-Bromo-4-(trifluoromethoxy)benzene
TL;DR: 1-Bromo-4-(trifluoromethoxy)benzene (CAS 407-14-7) is a chemical compound with molecular formula C7H4BrF3O and molecular weight 239.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-(trifluoromethoxy)benzene
Also Known As: 1-Bromo-4-(trifluoromethoxy)benzene, 4-(Trifluoromethoxy)bromobenzene, 4-Bromo(trifluoromethoxy)benzene, 4-trifluoromethoxybromobenzene, p-bromotrifluoromethoxybenzene
| Molecular Formula | C7H4BrF3O |
|---|---|
| Molecular Weight | 239.94 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.93976 |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 407-14-7 |
|---|---|
| SMILES | C1=CC(=CC=C1OC(F)(F)F)Br |
| InChIKey | SEAOBYFQWJFORM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-4-(trifluoromethoxy)benzene (CAS 407-14-7), with molecular formula C7H4BrF3O and molecular weight 239.94 g/mol. IUPAC: 1-bromo-4-(trifluoromethoxy)benzene.
Chemical Property Profile of 1-Bromo-4-(trifluoromethoxy)benzene
Property Insights of 1-Bromo-4-(trifluoromethoxy)benzene
The XLogP value of 3.8 indicates that 1-Bromo-4-(trifluoromethoxy)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-(trifluoromethoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-4-(trifluoromethoxy)benzene 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
Frequently Asked Questions
What is the CAS number of 1-Bromo-4-(trifluoromethoxy)benzene?
The CAS number of 1-Bromo-4-(trifluoromethoxy)benzene is 407-14-7.
What is the molecular formula of 1-Bromo-4-(trifluoromethoxy)benzene?
The molecular formula of 1-Bromo-4-(trifluoromethoxy)benzene is C7H4BrF3O.
What is the molecular weight of 1-Bromo-4-(trifluoromethoxy)benzene?
The molecular weight of 1-Bromo-4-(trifluoromethoxy)benzene is 239.94 g/mol.
Where can I buy 1-Bromo-4-(trifluoromethoxy)benzene?
You can request a quote for 1-Bromo-4-(trifluoromethoxy)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-(trifluoromethoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-4-(trifluoromethoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.