4-Bromo-2-(difluoromethyl)-1-fluorobenzene
TL;DR: 4-Bromo-2-(difluoromethyl)-1-fluorobenzene (CAS 445303-69-5) is a chemical compound with molecular formula C7H4BrF3 and molecular weight 223.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-(difluoromethyl)-1-fluorobenzene
Also Known As: 4-bromo-2-(difluoromethyl)-1-fluorobenzene, 4-Bromo-2-difluoromethyl-1-fluorobenzene, 2,4,5-Trichlorophenyl isothiocyanate, 4-bromo-2-(difluoromethyl)-1-fluoro-benzene, 4-bromo-1-fluoro-2-(difluoromethyl)benzene
| Molecular Formula | C7H4BrF3 |
|---|---|
| Molecular Weight | 223.94 g/mol |
| LogP | 3.5258 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.94485 |
| Heavy Atoms | 11 |
| Complexity | 259.86264 |
Chemical Identifiers
| CAS Number | 445303-69-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)C(F)F)F |
Product Overview
4-Bromo-2-(difluoromethyl)-1-fluorobenzene (CAS 445303-69-5), with molecular formula C7H4BrF3 and molecular weight 223.94 g/mol. IUPAC: 4-bromo-2-(difluoromethyl)-1-fluorobenzene.
Chemical Property Profile of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene
Property Insights of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene
The XLogP value of 3.5258 indicates that 4-Bromo-2-(difluoromethyl)-1-fluorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Bromo-2-(difluoromethyl)-1-fluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-(difluoromethyl)-1-fluorobenzene has 0 hydrogen bond donor(s) and 0 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-(difluoromethyl)-1-fluorobenzene?
The CAS number of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene is 445303-69-5.
What is the molecular formula of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene?
The molecular formula of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene is C7H4BrF3.
What is the molecular weight of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene?
The molecular weight of 4-Bromo-2-(difluoromethyl)-1-fluorobenzene is 223.94 g/mol.
Where can I buy 4-Bromo-2-(difluoromethyl)-1-fluorobenzene?
You can request a quote for 4-Bromo-2-(difluoromethyl)-1-fluorobenzene 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-(difluoromethyl)-1-fluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-(difluoromethyl)-1-fluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.