2,6-Difluoro-4-methoxybenzyl bromide
TL;DR: 2,6-Difluoro-4-methoxybenzyl bromide (CAS 111388-49-9) is a chemical compound with molecular formula C8H7BrF2O and molecular weight 235.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-1,3-difluoro-5-methoxybenzene
Also Known As: 2,6-Difluoro-4-methoxybenzyl bromide, 2-(bromomethyl)-1,3-difluoro-5-methoxybenzene, 2,6-DIFLUORO-4-METHOXYBENZYLBROMIDE, Benzamidine, N-phenyl-, 2,6-difluoro-4-methoxybenzyl?bromide
| Molecular Formula | C8H7BrF2O |
|---|---|
| Molecular Weight | 235.96 g/mol |
| LogP | 2.8683 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.96483 |
| Heavy Atoms | 12 |
| Complexity | 265.3815 |
Chemical Identifiers
| CAS Number | 111388-49-9 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)F)CBr)F |
Product Overview
2,6-Difluoro-4-methoxybenzyl bromide (CAS 111388-49-9), with molecular formula C8H7BrF2O and molecular weight 235.96 g/mol. IUPAC: 2-(bromomethyl)-1,3-difluoro-5-methoxybenzene.
Chemical Property Profile of 2,6-Difluoro-4-methoxybenzyl bromide
Property Insights of 2,6-Difluoro-4-methoxybenzyl bromide
The XLogP value of 2.8683 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Difluoro-4-methoxybenzyl bromide. With a topological polar surface area (TPSA) of 9.23 Ų, 2,6-Difluoro-4-methoxybenzyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Difluoro-4-methoxybenzyl bromide has 0 hydrogen bond donor(s) and 1 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 2,6-Difluoro-4-methoxybenzyl bromide?
The CAS number of 2,6-Difluoro-4-methoxybenzyl bromide is 111388-49-9.
What is the molecular formula of 2,6-Difluoro-4-methoxybenzyl bromide?
The molecular formula of 2,6-Difluoro-4-methoxybenzyl bromide is C8H7BrF2O.
What is the molecular weight of 2,6-Difluoro-4-methoxybenzyl bromide?
The molecular weight of 2,6-Difluoro-4-methoxybenzyl bromide is 235.96 g/mol.
Where can I buy 2,6-Difluoro-4-methoxybenzyl bromide?
You can request a quote for 2,6-Difluoro-4-methoxybenzyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Difluoro-4-methoxybenzyl bromide?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Difluoro-4-methoxybenzyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.