Cis-3,4-dimethyl-thiacyclopentane
TL;DR: Cis-3,4-dimethyl-thiacyclopentane (CAS 5161-11-5) is a chemical compound with molecular formula C6H12S and molecular weight 116.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S)-3,4-dimethylthiolane
Also Known As: cis-3,4-dimethyl-thiacyclopentane, (3R,4S)-3,4-dimethylthiolane, cis- 3,4-Dimethylthiacyclopentan, Thiophene, tetrahydro-3,4-dimethyl-, cis-, RefChem:334223
| Molecular Formula | C6H12S |
|---|---|
| Molecular Weight | 116.07 g/mol |
| LogP | 2.0054 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.06597 |
| Heavy Atoms | 7 |
| Complexity | 53.20036 |
Chemical Identifiers
| CAS Number | 5161-11-5 |
|---|---|
| SMILES | C[C@@H]1CSC[C@@H]1C |
Product Overview
Cis-3,4-dimethyl-thiacyclopentane (CAS 5161-11-5), with molecular formula C6H12S and molecular weight 116.07 g/mol. IUPAC: (3R,4S)-3,4-dimethylthiolane.
Chemical Property Profile of Cis-3,4-dimethyl-thiacyclopentane
Property Insights of Cis-3,4-dimethyl-thiacyclopentane
The XLogP value of 2.0054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cis-3,4-dimethyl-thiacyclopentane. With a topological polar surface area (TPSA) of 0.0 Ų, Cis-3,4-dimethyl-thiacyclopentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cis-3,4-dimethyl-thiacyclopentane has 0 hydrogen bond donor(s) and 1 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 Cis-3,4-dimethyl-thiacyclopentane?
The CAS number of Cis-3,4-dimethyl-thiacyclopentane is 5161-11-5.
What is the molecular formula of Cis-3,4-dimethyl-thiacyclopentane?
The molecular formula of Cis-3,4-dimethyl-thiacyclopentane is C6H12S.
What is the molecular weight of Cis-3,4-dimethyl-thiacyclopentane?
The molecular weight of Cis-3,4-dimethyl-thiacyclopentane is 116.07 g/mol.
Where can I buy Cis-3,4-dimethyl-thiacyclopentane?
You can request a quote for Cis-3,4-dimethyl-thiacyclopentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cis-3,4-dimethyl-thiacyclopentane?
Yes, KEHONG BIO provides custom synthesis services for Cis-3,4-dimethyl-thiacyclopentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.