3,4,5-Tribromophenol
TL;DR: 3,4,5-Tribromophenol (CAS 116434-90-3) is a chemical compound with molecular formula C6H3Br3O and molecular weight 327.7734 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,5-tribromophenol
Also Known As: 3,4,5-tribromophenol, 1-Oxy-3,4,5-Tribrombenzol, 3,4,5-Tribromophenol 100 microg/mL in toluene, 818-874-4
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H3Br3O |
| Molecular Weight | 327.7734 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.77136 Da |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
| SMILES | C1=C(C=C(C(=C1Br)Br)Br)O |
| InChIKey | KAVNMOZXRFSVPM-UHFFFAOYSA-N |
Chemical Property Profile of 3,4,5-Tribromophenol
Property Insights of 3,4,5-Tribromophenol
The XLogP value of 3.6 indicates that 3,4,5-Tribromophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3,4,5-Tribromophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Tribromophenol 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
What is the CAS number of 3,4,5-Tribromophenol?
The CAS number of 3,4,5-Tribromophenol is 116434-90-3.
What is the molecular formula of 3,4,5-Tribromophenol?
The molecular formula of 3,4,5-Tribromophenol is C6H3Br3O.
What is the molecular weight of 3,4,5-Tribromophenol?
The molecular weight of 3,4,5-Tribromophenol is 327.7734 g/mol.
Where can I buy 3,4,5-Tribromophenol?
You can request a quote for 3,4,5-Tribromophenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4,5-Tribromophenol?
Yes, CoreyChem provides custom synthesis services for 3,4,5-Tribromophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.