1,2,7,8-Tetrachlorodibenzothiophene
TL;DR: 1,2,7,8-Tetrachlorodibenzothiophene (CAS 133513-15-2) is a chemical compound with molecular formula C12H4Cl4S and molecular weight 319.87878 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,7,8-tetrachlorodibenzothiophene
Also Known As: 1,2,7,8-tetrachlorodibenzothiophene, Dibenzothiophene, 1,2,7,8-tetrachloro-, 1,2,7,8-Tetrachlorodibenzo[b,d]thiophene
Technical Specifications
| Molecular Formula | C12H4Cl4S |
| Molecular Weight | 319.87878 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 319.87878 Da |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
| SMILES | C1=CC(=C(C2=C1SC3=CC(=C(C=C32)Cl)Cl)Cl)Cl |
| InChIKey | GALBCWISNKMGTL-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,7,8-Tetrachlorodibenzothiophene
Property Insights of 1,2,7,8-Tetrachlorodibenzothiophene
The XLogP value of 6.8 indicates that 1,2,7,8-Tetrachlorodibenzothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 1,2,7,8-Tetrachlorodibenzothiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,7,8-Tetrachlorodibenzothiophene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,2,7,8-Tetrachlorodibenzothiophene?
The CAS number of 1,2,7,8-Tetrachlorodibenzothiophene is 133513-15-2.
What is the molecular formula of 1,2,7,8-Tetrachlorodibenzothiophene?
The molecular formula of 1,2,7,8-Tetrachlorodibenzothiophene is C12H4Cl4S.
What is the molecular weight of 1,2,7,8-Tetrachlorodibenzothiophene?
The molecular weight of 1,2,7,8-Tetrachlorodibenzothiophene is 319.87878 g/mol.
Where can I buy 1,2,7,8-Tetrachlorodibenzothiophene?
You can request a quote for 1,2,7,8-Tetrachlorodibenzothiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,7,8-Tetrachlorodibenzothiophene?
Yes, CoreyChem provides custom synthesis services for 1,2,7,8-Tetrachlorodibenzothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.