3,6-Dichlorobenzene-1,2-dithiol
TL;DR: 3,6-Dichlorobenzene-1,2-dithiol (CAS 87314-49-6) is a chemical compound with molecular formula C6H4Cl2S2 and molecular weight 209.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dichlorobenzene-1,2-dithiol
Also Known As: 3,6-dichlorobenzene-1,2-dithiol, 3,6-Dichloro-1,2-benzenedithiol, 1,2-Benzenedithiol, 3,6-dichloro-, 1,4-Dichlorobenzene-2,3-dithiol, 3,6-Dichloro-1,2-benzenebisthiol
| Molecular Formula | C6H4Cl2S2 |
|---|---|
| Molecular Weight | 209.91 g/mol |
| LogP | 3.5708 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.91315 |
| Heavy Atoms | 10 |
| Complexity | 233.16988 |
Chemical Identifiers
| CAS Number | 87314-49-6 |
|---|---|
| SMILES | C1=CC(=C(C(=C1Cl)S)S)Cl |
Product Overview
3,6-Dichlorobenzene-1,2-dithiol (CAS 87314-49-6), with molecular formula C6H4Cl2S2 and molecular weight 209.91 g/mol. IUPAC: 3,6-dichlorobenzene-1,2-dithiol.
Chemical Property Profile of 3,6-Dichlorobenzene-1,2-dithiol
Property Insights of 3,6-Dichlorobenzene-1,2-dithiol
The XLogP value of 3.5708 indicates that 3,6-Dichlorobenzene-1,2-dithiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,6-Dichlorobenzene-1,2-dithiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dichlorobenzene-1,2-dithiol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-Dichlorobenzene-1,2-dithiol?
The CAS number of 3,6-Dichlorobenzene-1,2-dithiol is 87314-49-6.
What is the molecular formula of 3,6-Dichlorobenzene-1,2-dithiol?
The molecular formula of 3,6-Dichlorobenzene-1,2-dithiol is C6H4Cl2S2.
What is the molecular weight of 3,6-Dichlorobenzene-1,2-dithiol?
The molecular weight of 3,6-Dichlorobenzene-1,2-dithiol is 209.91 g/mol.
Where can I buy 3,6-Dichlorobenzene-1,2-dithiol?
You can request a quote for 3,6-Dichlorobenzene-1,2-dithiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dichlorobenzene-1,2-dithiol?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dichlorobenzene-1,2-dithiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.