2-(Dichloromethylidene)-1,3-dithiane
TL;DR: 2-(Dichloromethylidene)-1,3-dithiane (CAS 70063-48-8) is a chemical compound with molecular formula C5H6Cl2S2 and molecular weight 199.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dichloromethylidene)-1,3-dithiane
Also Known As: 2-(dichloromethylidene)-1,3-dithiane, 2-(Dichloromethylene)-1,3-dithiane
| Molecular Formula | C5H6Cl2S2 |
|---|---|
| Molecular Weight | 199.93 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.9288 |
| Heavy Atoms | 9 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 70063-48-8 |
|---|---|
| SMILES | C1CSC(=C(Cl)Cl)SC1 |
| InChIKey | ZUGGTUKYLPRIHM-UHFFFAOYSA-N |
Product Overview
2-(Dichloromethylidene)-1,3-dithiane (CAS 70063-48-8), with molecular formula C5H6Cl2S2 and molecular weight 199.93 g/mol. IUPAC: 2-(dichloromethylidene)-1,3-dithiane.
Chemical Property Profile of 2-(Dichloromethylidene)-1,3-dithiane
Property Insights of 2-(Dichloromethylidene)-1,3-dithiane
The XLogP value of 3.3 indicates that 2-(Dichloromethylidene)-1,3-dithiane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 2-(Dichloromethylidene)-1,3-dithiane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dichloromethylidene)-1,3-dithiane has 0 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 2-(Dichloromethylidene)-1,3-dithiane?
The CAS number of 2-(Dichloromethylidene)-1,3-dithiane is 70063-48-8.
What is the molecular formula of 2-(Dichloromethylidene)-1,3-dithiane?
The molecular formula of 2-(Dichloromethylidene)-1,3-dithiane is C5H6Cl2S2.
What is the molecular weight of 2-(Dichloromethylidene)-1,3-dithiane?
The molecular weight of 2-(Dichloromethylidene)-1,3-dithiane is 199.93 g/mol.
Where can I buy 2-(Dichloromethylidene)-1,3-dithiane?
You can request a quote for 2-(Dichloromethylidene)-1,3-dithiane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dichloromethylidene)-1,3-dithiane?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dichloromethylidene)-1,3-dithiane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.