1-(2-Bromoethyl)-4-chlorobenzene
TL;DR: 1-(2-Bromoethyl)-4-chlorobenzene (CAS 6529-53-9) is a chemical compound with molecular formula C8H8BrCl and molecular weight 217.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromoethyl)-4-chlorobenzene
Also Known As: 1-(2-BROMOETHYL)-4-CHLOROBENZENE, 4-Chlorophenethyl bromide, p-Chlorophenethyl bromide, 2-(4-chlorophenyl)ethylbromide, 1-Bromo-2-(4-chlorophenyl)ethane
| Molecular Formula | C8H8BrCl |
|---|---|
| Molecular Weight | 217.95 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.94978 |
| Heavy Atoms | 10 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 6529-53-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CCBr)Cl |
| InChIKey | YAFMYKFAUNCQPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Bromoethyl)-4-chlorobenzene (CAS 6529-53-9), with molecular formula C8H8BrCl and molecular weight 217.95 g/mol. IUPAC: 1-(2-bromoethyl)-4-chlorobenzene.
Chemical Property Profile of 1-(2-Bromoethyl)-4-chlorobenzene
Property Insights of 1-(2-Bromoethyl)-4-chlorobenzene
The XLogP value of 3.7 indicates that 1-(2-Bromoethyl)-4-chlorobenzene 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-(2-Bromoethyl)-4-chlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromoethyl)-4-chlorobenzene 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-(2-Bromoethyl)-4-chlorobenzene?
The CAS number of 1-(2-Bromoethyl)-4-chlorobenzene is 6529-53-9.
What is the molecular formula of 1-(2-Bromoethyl)-4-chlorobenzene?
The molecular formula of 1-(2-Bromoethyl)-4-chlorobenzene is C8H8BrCl.
What is the molecular weight of 1-(2-Bromoethyl)-4-chlorobenzene?
The molecular weight of 1-(2-Bromoethyl)-4-chlorobenzene is 217.95 g/mol.
Where can I buy 1-(2-Bromoethyl)-4-chlorobenzene?
You can request a quote for 1-(2-Bromoethyl)-4-chlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromoethyl)-4-chlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromoethyl)-4-chlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.