p-Bromochlorobenzene
TL;DR: p-Bromochlorobenzene (CAS 106-39-8) is a chemical compound with molecular formula C6H4BrCl and molecular weight 189.91849 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromo-4-chlorobenzene
Also Known As: 1-Bromo-4-chlorobenzene, 4-BROMOCHLOROBENZENE, p-Bromochlorobenzene, 4-Chlorobromobenzene, p-Chlorobromobenzene
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H4BrCl |
| Molecular Weight | 189.91849 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.91849 Da |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
| Melting Point | 68 °C |
| Boiling Point | 196 °C @760 [mm Hg] |
| Density | 1.576 @ 71°C |
| Vapor Pressure | 0.25 [mmHg] |
| SMILES | C1=CC(=CC=C1Cl)Br |
| InChIKey | NHDODQWIKUYWMW-UHFFFAOYSA-N |
Product Description
Applications: p-Bromochlorobenzene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
p-Bromochlorobenzene (CAS 106-39-8) is a heterocyclic building block with the molecular formula C6H4BrCl and a molecular weight of 189.92 g/mol. Key physical properties include a density of 1.576 @ 71°C g/cm³. Synonyms include 1-Bromo-4-chlorobenzene and 4-BROMOCHLOROBENZENE.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of p-Bromochlorobenzene
Property Insights of p-Bromochlorobenzene
The XLogP value of 3.7 indicates that p-Bromochlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, p-Bromochlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Bromochlorobenzene 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
What is the CAS number of p-Bromochlorobenzene?
The CAS number of p-Bromochlorobenzene is 106-39-8.
What is the molecular formula of p-Bromochlorobenzene?
The molecular formula of p-Bromochlorobenzene is C6H4BrCl.
What is the molecular weight of p-Bromochlorobenzene?
The molecular weight of p-Bromochlorobenzene is 189.91849 g/mol.
What are the applications of p-Bromochlorobenzene?
p-Bromochlorobenzene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as...
Where can I buy p-Bromochlorobenzene?
You can request a quote for p-Bromochlorobenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-Bromochlorobenzene?
Yes, CoreyChem provides custom synthesis services for p-Bromochlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.