Pentafluorobenzyl bromide
TL;DR: Pentafluorobenzyl bromide (CAS 1765-40-8) is a chemical compound with molecular formula C7H2BrF5 and molecular weight 259.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(bromomethyl)-2,3,4,5,6-pentafluorobenzene
Also Known As: 2,3,4,5,6-Pentafluorobenzyl bromide, Pentafluorobenzyl bromide, (Bromomethyl)pentafluorobenzene, PFBBR, 1-(Bromomethyl)-2,3,4,5,6-pentafluorobenzene
| Molecular Formula | C7H2BrF5 |
|---|---|
| Molecular Weight | 259.93 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.926 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 1765-40-8 |
|---|---|
| SMILES | C(C1=C(C(=C(C(=C1F)F)F)F)F)Br |
| InChIKey | XDEPVFFKOVDUNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentafluorobenzyl bromide (CAS 1765-40-8), with molecular formula C7H2BrF5 and molecular weight 259.93 g/mol. IUPAC: 1-(bromomethyl)-2,3,4,5,6-pentafluorobenzene.
Chemical Property Profile of Pentafluorobenzyl bromide
Property Insights of Pentafluorobenzyl bromide
The XLogP value of 3.0 indicates that Pentafluorobenzyl bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pentafluorobenzyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentafluorobenzyl bromide has 0 hydrogen bond donor(s) and 5 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 Pentafluorobenzyl bromide?
The CAS number of Pentafluorobenzyl bromide is 1765-40-8.
What is the molecular formula of Pentafluorobenzyl bromide?
The molecular formula of Pentafluorobenzyl bromide is C7H2BrF5.
What is the molecular weight of Pentafluorobenzyl bromide?
The molecular weight of Pentafluorobenzyl bromide is 259.93 g/mol.
Where can I buy Pentafluorobenzyl bromide?
You can request a quote for Pentafluorobenzyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentafluorobenzyl bromide?
Yes, KEHONG BIO provides custom synthesis services for Pentafluorobenzyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.