2,4,6-Tribromothiophenol
TL;DR: 2,4,6-Tribromothiophenol (CAS 57730-98-0) is a chemical compound with molecular formula C6H3Br3S and molecular weight 343.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tribromobenzenethiol
Also Known As: 2,4,6-Tribromothiophenol, 2,4,6-tribromobenzenethiol, benzenethiol 2,4,6-tribromine, Benzenethiol-2,4,6-tribromide, Bromodifluoroacetylfluoride
| Molecular Formula | C6H3Br3S |
|---|---|
| Molecular Weight | 343.75 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 343.75055 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 57730-98-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Br)S)Br)Br |
| InChIKey | CSGWTASASRPRAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Tribromothiophenol (CAS 57730-98-0), with molecular formula C6H3Br3S and molecular weight 343.75 g/mol. IUPAC: 2,4,6-tribromobenzenethiol.
Chemical Property Profile of 2,4,6-Tribromothiophenol
Property Insights of 2,4,6-Tribromothiophenol
The XLogP value of 4.1 indicates that 2,4,6-Tribromothiophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, 2,4,6-Tribromothiophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Tribromothiophenol 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 2,4,6-Tribromothiophenol?
The CAS number of 2,4,6-Tribromothiophenol is 57730-98-0.
What is the molecular formula of 2,4,6-Tribromothiophenol?
The molecular formula of 2,4,6-Tribromothiophenol is C6H3Br3S.
What is the molecular weight of 2,4,6-Tribromothiophenol?
The molecular weight of 2,4,6-Tribromothiophenol is 343.75 g/mol.
Where can I buy 2,4,6-Tribromothiophenol?
You can request a quote for 2,4,6-Tribromothiophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Tribromothiophenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tribromothiophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.