1-Bromo-2,4,5-trichlorobenzene
TL;DR: 1-Bromo-2,4,5-trichlorobenzene (CAS 29682-44-8) is a chemical compound with molecular formula C6H2BrCl3 and molecular weight 257.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2,4,5-trichlorobenzene
Also Known As: 1-Bromo-2,4,5-trichlorobenzene, null, 2,4,5-Trichlorobromobenzene, BENZENE, 1-BROMO-2,4,5-TRICHLORO-, 1-brom-2,4,5-trichlorbenzol
| Molecular Formula | C6H2BrCl3 |
|---|---|
| Molecular Weight | 257.84 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 257.84055 |
| Heavy Atoms | 10 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 29682-44-8 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Br)Cl)Cl |
| InChIKey | PHDKZIIWDGIUCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-2,4,5-trichlorobenzene (CAS 29682-44-8), with molecular formula C6H2BrCl3 and molecular weight 257.84 g/mol. IUPAC: 1-bromo-2,4,5-trichlorobenzene.
Chemical Property Profile of 1-Bromo-2,4,5-trichlorobenzene
Property Insights of 1-Bromo-2,4,5-trichlorobenzene
The XLogP value of 4.5 indicates that 1-Bromo-2,4,5-trichlorobenzene 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-Bromo-2,4,5-trichlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2,4,5-trichlorobenzene 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-Bromo-2,4,5-trichlorobenzene?
The CAS number of 1-Bromo-2,4,5-trichlorobenzene is 29682-44-8.
What is the molecular formula of 1-Bromo-2,4,5-trichlorobenzene?
The molecular formula of 1-Bromo-2,4,5-trichlorobenzene is C6H2BrCl3.
What is the molecular weight of 1-Bromo-2,4,5-trichlorobenzene?
The molecular weight of 1-Bromo-2,4,5-trichlorobenzene is 257.84 g/mol.
Where can I buy 1-Bromo-2,4,5-trichlorobenzene?
You can request a quote for 1-Bromo-2,4,5-trichlorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2,4,5-trichlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2,4,5-trichlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.