1-Bromo-3,5-bis(trifluoromethyl)benzene
TL;DR: 1-Bromo-3,5-bis(trifluoromethyl)benzene (CAS 328-70-1) is a chemical compound with molecular formula C8H3BrF6 and molecular weight 291.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3,5-bis(trifluoromethyl)benzene
Also Known As: 3,5-Bis(trifluoromethyl)bromobenzene, 1-Bromo-3,5-bis(trifluoromethyl)benzene, fxffr ce exfff, 1,3-Bis(trifluoromethyl)-5-bromobenzene, 2-Tolualdehyde
| Molecular Formula | C8H3BrF6 |
|---|---|
| Molecular Weight | 291.93 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 291.93222 |
| Heavy Atoms | 15 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 328-70-1 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F |
| InChIKey | CSVCVIHEBDJTCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-3,5-bis(trifluoromethyl)benzene (CAS 328-70-1), with molecular formula C8H3BrF6 and molecular weight 291.93 g/mol. IUPAC: 1-bromo-3,5-bis(trifluoromethyl)benzene.
Chemical Property Profile of 1-Bromo-3,5-bis(trifluoromethyl)benzene
Property Insights of 1-Bromo-3,5-bis(trifluoromethyl)benzene
The XLogP value of 4.9 indicates that 1-Bromo-3,5-bis(trifluoromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Bromo-3,5-bis(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-3,5-bis(trifluoromethyl)benzene has 0 hydrogen bond donor(s) and 6 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-3,5-bis(trifluoromethyl)benzene?
The CAS number of 1-Bromo-3,5-bis(trifluoromethyl)benzene is 328-70-1.
What is the molecular formula of 1-Bromo-3,5-bis(trifluoromethyl)benzene?
The molecular formula of 1-Bromo-3,5-bis(trifluoromethyl)benzene is C8H3BrF6.
What is the molecular weight of 1-Bromo-3,5-bis(trifluoromethyl)benzene?
The molecular weight of 1-Bromo-3,5-bis(trifluoromethyl)benzene is 291.93 g/mol.
Where can I buy 1-Bromo-3,5-bis(trifluoromethyl)benzene?
You can request a quote for 1-Bromo-3,5-bis(trifluoromethyl)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-3,5-bis(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-3,5-bis(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.