1-Bromomethyl-2,6-dichlorobenzene
TL;DR: 1-Bromomethyl-2,6-dichlorobenzene (CAS 20443-98-5) is a chemical compound with molecular formula C7H5BrCl2 and molecular weight 237.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-1,3-dichlorobenzene
Also Known As: 2,6-Dichlorobenzyl bromide, 2-(Bromomethyl)-1,3-dichlorobenzene, alpha-Bromo-2,6-dichlorotoluene, Benzene, 2-(bromomethyl)-1,3-dichloro-, 1-Bromomethyl-2,6-dichlorobenzene
| Molecular Formula | C7H5BrCl2 |
|---|---|
| Molecular Weight | 237.90 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.89517 |
| Heavy Atoms | 10 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 20443-98-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CBr)Cl |
| InChIKey | PDFGFQUSSYSWNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromomethyl-2,6-dichlorobenzene (CAS 20443-98-5), with molecular formula C7H5BrCl2 and molecular weight 237.90 g/mol. IUPAC: 2-(bromomethyl)-1,3-dichlorobenzene.
Chemical Property Profile of 1-Bromomethyl-2,6-dichlorobenzene
Property Insights of 1-Bromomethyl-2,6-dichlorobenzene
The XLogP value of 3.7 indicates that 1-Bromomethyl-2,6-dichlorobenzene 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-Bromomethyl-2,6-dichlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromomethyl-2,6-dichlorobenzene 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 1-Bromomethyl-2,6-dichlorobenzene?
The CAS number of 1-Bromomethyl-2,6-dichlorobenzene is 20443-98-5.
What is the molecular formula of 1-Bromomethyl-2,6-dichlorobenzene?
The molecular formula of 1-Bromomethyl-2,6-dichlorobenzene is C7H5BrCl2.
What is the molecular weight of 1-Bromomethyl-2,6-dichlorobenzene?
The molecular weight of 1-Bromomethyl-2,6-dichlorobenzene is 237.90 g/mol.
Where can I buy 1-Bromomethyl-2,6-dichlorobenzene?
You can request a quote for 1-Bromomethyl-2,6-dichlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromomethyl-2,6-dichlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromomethyl-2,6-dichlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.