Bithionol
TL;DR: Bithionol (CAS 97-18-7) is a chemical compound with molecular formula C12H6Cl4O2S and molecular weight 353.88425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dichloro-6-(3,5-dichloro-2-hydroxyphenyl)sulfanylphenol
Also Known As: bithionol, Bithin, Lorothidol, Actamer, Bitionol
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H6Cl4O2S |
| Molecular Weight | 353.88425 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 65.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.88132 Da |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
| Melting Point | 365.9 to 367.7 °F (NTP, 1992) |
| Density | 1.73 (NTP, 1992) - Denser than water; will sink |
| Vapor Pressure | 1.1e-09 mmHg at 99 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| SMILES | C1=C(C=C(C(=C1SC2=C(C(=CC(=C2)Cl)Cl)O)O)Cl)Cl |
| InChIKey | JFIOVJDNOJYLKP-UHFFFAOYSA-N |
Product Description
Applications: Bithionol is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Bithionol (CAS 97-18-7) is a pharmaceutical intermediate with the molecular formula C12H6Cl4O2S and a molecular weight of 353.88 g/mol. Key physical properties include a density of 1.73 (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 73 °F (NTP, 1992). Synonyms include bithionol and Bithin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bithionol
Property Insights of Bithionol
The XLogP value of 5.8 indicates that Bithionol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Bithionol. Following Lipinski's Rule of Five, Bithionol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bithionol?
The CAS number of Bithionol is 97-18-7.
What is the molecular formula of Bithionol?
The molecular formula of Bithionol is C12H6Cl4O2S.
What is the molecular weight of Bithionol?
The molecular weight of Bithionol is 353.88425 g/mol.
What are the applications of Bithionol?
Bithionol is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis...
Where can I buy Bithionol?
You can request a quote for Bithionol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bithionol?
Yes, CoreyChem provides custom synthesis services for Bithionol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.