2,4,8-Trichlorophenoxathiine
TL;DR: 2,4,8-Trichlorophenoxathiine (CAS 6345-13-7) is a chemical compound with molecular formula C12H5Cl3OS and molecular weight 301.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,8-trichlorophenoxathiine
Also Known As: 2,4,8-trichlorophenoxathiine, Phenoxathiin, 2,4,8-trichloro-, 2,3,7,8-tetrachlorophenoxthin
| Molecular Formula | C12H5Cl3OS |
|---|---|
| Molecular Weight | 301.91 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 301.91266 |
| Heavy Atoms | 17 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 6345-13-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)SC3=C(O2)C(=CC(=C3)Cl)Cl |
| InChIKey | HMRFXMBURZXZIF-UHFFFAOYSA-N |
Product Overview
2,4,8-Trichlorophenoxathiine (CAS 6345-13-7), with molecular formula C12H5Cl3OS and molecular weight 301.91 g/mol. IUPAC: 2,4,8-trichlorophenoxathiine.
Chemical Property Profile of 2,4,8-Trichlorophenoxathiine
Property Insights of 2,4,8-Trichlorophenoxathiine
The XLogP value of 5.5 indicates that 2,4,8-Trichlorophenoxathiine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.5 Ų, 2,4,8-Trichlorophenoxathiine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,8-Trichlorophenoxathiine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,8-Trichlorophenoxathiine?
The CAS number of 2,4,8-Trichlorophenoxathiine is 6345-13-7.
What is the molecular formula of 2,4,8-Trichlorophenoxathiine?
The molecular formula of 2,4,8-Trichlorophenoxathiine is C12H5Cl3OS.
What is the molecular weight of 2,4,8-Trichlorophenoxathiine?
The molecular weight of 2,4,8-Trichlorophenoxathiine is 301.91 g/mol.
Where can I buy 2,4,8-Trichlorophenoxathiine?
You can request a quote for 2,4,8-Trichlorophenoxathiine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,8-Trichlorophenoxathiine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,8-Trichlorophenoxathiine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.