4-Bromo-2,3,6-trichlorophenol
TL;DR: 4-Bromo-2,3,6-trichlorophenol (CAS 13311-72-3) is a chemical compound with molecular formula C6H2BrCl3O and molecular weight 273.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2,3,6-trichlorophenol
Also Known As: 4-Bromo-2,3,6-trichlorophenol, Phenol, 4-bromo-2,3,6-trichloro-, 2,5,6-Trichloro-4-bromophenol, 4-bromo-2,3,6-trichloro-phenol, Phenol,4-bromo-2,3,6-trichloro-
| Molecular Formula | C6H2BrCl3O |
|---|---|
| Molecular Weight | 273.84 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 273.83545 |
| Heavy Atoms | 11 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 13311-72-3 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)Cl)Cl)O)Cl |
| InChIKey | QXTYKQOYAPZQOA-UHFFFAOYSA-N |
Product Overview
4-Bromo-2,3,6-trichlorophenol (CAS 13311-72-3), with molecular formula C6H2BrCl3O and molecular weight 273.84 g/mol. IUPAC: 4-bromo-2,3,6-trichlorophenol.
Chemical Property Profile of 4-Bromo-2,3,6-trichlorophenol
Property Insights of 4-Bromo-2,3,6-trichlorophenol
The XLogP value of 4.5 indicates that 4-Bromo-2,3,6-trichlorophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Bromo-2,3,6-trichlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2,3,6-trichlorophenol has 1 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 4-Bromo-2,3,6-trichlorophenol?
The CAS number of 4-Bromo-2,3,6-trichlorophenol is 13311-72-3.
What is the molecular formula of 4-Bromo-2,3,6-trichlorophenol?
The molecular formula of 4-Bromo-2,3,6-trichlorophenol is C6H2BrCl3O.
What is the molecular weight of 4-Bromo-2,3,6-trichlorophenol?
The molecular weight of 4-Bromo-2,3,6-trichlorophenol is 273.84 g/mol.
Where can I buy 4-Bromo-2,3,6-trichlorophenol?
You can request a quote for 4-Bromo-2,3,6-trichlorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2,3,6-trichlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2,3,6-trichlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.