Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-
TL;DR: Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- (CAS 639826-18-9) is a chemical compound with molecular formula C8H6BrClF2O and molecular weight 269.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-4-chloro-1-(difluoromethoxy)benzene
Also Known As: 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)benzene, 2-Bromomethyl-4-chloro-1-difluoromethoxy-benzene, 5-Chloro-2-(difluoromethoxy)benzyl bromide, Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-, 973-004-1
| Molecular Formula | C8H6BrClF2O |
|---|---|
| Molecular Weight | 269.93 g/mol |
| LogP | 3.8363 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.92587 |
| Heavy Atoms | 13 |
| Complexity | 293.47256 |
Chemical Identifiers
| CAS Number | 639826-18-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)CBr)OC(F)F |
Product Overview
Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- (CAS 639826-18-9), with molecular formula C8H6BrClF2O and molecular weight 269.93 g/mol. IUPAC: 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)benzene.
Chemical Property Profile of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-
Property Insights of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-
The XLogP value of 3.8363 indicates that Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- 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 Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-?
The CAS number of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- is 639826-18-9.
What is the molecular formula of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-?
The molecular formula of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- is C8H6BrClF2O.
What is the molecular weight of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-?
The molecular weight of Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- is 269.93 g/mol.
Where can I buy Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-?
You can request a quote for Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 2-(bromomethyl)-4-chloro-1-(difluoromethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.