硫双二氯酚
TL;DR: 硫双二氯酚 (CAS 97-18-7) is a chemical compound with molecular formula C12H6Cl4O2S and molecular weight 353.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫双二氯酚
2,4-dichloro-6-(3,5-dichloro-2-hydroxyphenyl)sulfanylphenol
Also Known As: bithionol, Bithin, Lorothidol, Actamer, Bitionol
| Molecular Formula | C12H6Cl4O2S |
|---|---|
| Molecular Weight | 353.88 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.88132 |
| Heavy Atoms | 19 |
| Complexity | 281.0 |
| Melting Point | 365.9 to 186.5 °C |
| Density | 1.73 |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| Vapor Pressure | 1.1e-09 mmHg at 37.2 °C |
Chemical Identifiers
| CAS Number | 97-18-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1SC2=C(C(=CC(=C2)Cl)Cl)O)O)Cl)Cl |
| InChIKey | JFIOVJDNOJYLKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫双二氯酚 (CAS 97-18-7), with molecular formula C12H6Cl4O2S and molecular weight 353.88 g/mol. IUPAC: 2,4-dichloro-6-(3,5-dichloro-2-hydroxyphenyl)sulfanylphenol.
Chemical Property Profile of 硫双二氯酚
Property Insights of 硫双二氯酚
The XLogP value of 5.8 indicates that 硫双二氯酚 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 硫双二氯酚. Following Lipinski's Rule of Five, 硫双二氯酚 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫双二氯酚?
The CAS number of 硫双二氯酚 is 97-18-7.
What is the molecular formula of 硫双二氯酚?
The molecular formula of 硫双二氯酚 is C12H6Cl4O2S.
What is the molecular weight of 硫双二氯酚?
The molecular weight of 硫双二氯酚 is 353.88 g/mol.
Where can I buy 硫双二氯酚?
You can request a quote for 硫双二氯酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫双二氯酚?
Yes, KEHONG BIO provides custom synthesis services for 硫双二氯酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.