2,3,4,6-Tetrabromophenol
TL;DR: 2,3,4,6-Tetrabromophenol (CAS 14400-94-3) is a chemical compound with molecular formula C6H2Br4O and molecular weight 405.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,6-tetrabromophenol
Also Known As: 2,3,4,6-TETRABROMOPHENOL, Phenol, 2,3,4,6-tetrabromo-, 2,3,4,6-Tetrabrom-phenol, Phenol,2,3,4,6-tetrabromo-, RefChem:81277
| Molecular Formula | C6H2Br4O |
|---|---|
| Molecular Weight | 405.68 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 409.6798 |
| Heavy Atoms | 11 |
| Complexity | 143.0 |
| Melting Point | 113.5 °C |
| Boiling Point | Sublimes |
| Solubility | Very soluble in benzene, ethanol |
Chemical Identifiers
| CAS Number | 14400-94-3 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)Br)Br)O)Br |
| InChIKey | CXPJZISGVIVNEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4,6-Tetrabromophenol (CAS 14400-94-3), with molecular formula C6H2Br4O and molecular weight 405.68 g/mol. IUPAC: 2,3,4,6-tetrabromophenol.
Chemical Property Profile of 2,3,4,6-Tetrabromophenol
Property Insights of 2,3,4,6-Tetrabromophenol
The XLogP value of 5.4 indicates that 2,3,4,6-Tetrabromophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,3,4,6-Tetrabromophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,6-Tetrabromophenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,6-Tetrabromophenol?
The CAS number of 2,3,4,6-Tetrabromophenol is 14400-94-3.
What is the molecular formula of 2,3,4,6-Tetrabromophenol?
The molecular formula of 2,3,4,6-Tetrabromophenol is C6H2Br4O.
What is the molecular weight of 2,3,4,6-Tetrabromophenol?
The molecular weight of 2,3,4,6-Tetrabromophenol is 405.68 g/mol.
Where can I buy 2,3,4,6-Tetrabromophenol?
You can request a quote for 2,3,4,6-Tetrabromophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,6-Tetrabromophenol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,6-Tetrabromophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.