1,2,3-Trichlorothianthrene
TL;DR: 1,2,3-Trichlorothianthrene (CAS 134503-43-8) is a chemical compound with molecular formula C12H5Cl3S2 and molecular weight 317.88983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3-trichlorothianthrene
Also Known As: 1,2,3-trichlorothianthrene, trichlorothianthrene, J2.490.304D
Technical Specifications
| Molecular Formula | C12H5Cl3S2 |
| Molecular Weight | 317.88983 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 317.88983 Da |
| Heavy Atoms | 17 |
| Complexity | 289.0 |
| SMILES | C1=CC=C2C(=C1)SC3=CC(=C(C(=C3S2)Cl)Cl)Cl |
| InChIKey | RODFAVSUCQKPFM-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3-Trichlorothianthrene
Property Insights of 1,2,3-Trichlorothianthrene
The XLogP value of 6.0 indicates that 1,2,3-Trichlorothianthrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 1,2,3-Trichlorothianthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3-Trichlorothianthrene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,2,3-Trichlorothianthrene?
The CAS number of 1,2,3-Trichlorothianthrene is 134503-43-8.
What is the molecular formula of 1,2,3-Trichlorothianthrene?
The molecular formula of 1,2,3-Trichlorothianthrene is C12H5Cl3S2.
What is the molecular weight of 1,2,3-Trichlorothianthrene?
The molecular weight of 1,2,3-Trichlorothianthrene is 317.88983 g/mol.
Where can I buy 1,2,3-Trichlorothianthrene?
You can request a quote for 1,2,3-Trichlorothianthrene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3-Trichlorothianthrene?
Yes, CoreyChem provides custom synthesis services for 1,2,3-Trichlorothianthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.