1,3-Dithiolane, 4-methyl-
TL;DR: 1,3-Dithiolane, 4-methyl- (CAS 50363-43-4) is a chemical compound with molecular formula C4H8S2 and molecular weight 120.006744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-1,3-dithiolane
Also Known As: 4-Methyl-1,3-dithiolane, 1,3-DITHIOLANE, 4-METHYL-, 4-methyl-1,3-dithiacyclopentane, 5-19-01-00047 (Beilstein Handbook Reference), BRN 1361434
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H8S2 |
| Molecular Weight | 120.006744 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 120.006744 Da |
| Heavy Atoms | 6 |
| Complexity | 44.0 |
| SMILES | CC1CSCS1 |
| InChIKey | RCAGLIUGQCZIDE-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dithiolane, 4-methyl-
Property Insights of 1,3-Dithiolane, 4-methyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dithiolane, 4-methyl-. With a topological polar surface area (TPSA) of 50.6 Ų, 1,3-Dithiolane, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dithiolane, 4-methyl- 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
What is the CAS number of 1,3-Dithiolane, 4-methyl-?
The CAS number of 1,3-Dithiolane, 4-methyl- is 50363-43-4.
What is the molecular formula of 1,3-Dithiolane, 4-methyl-?
The molecular formula of 1,3-Dithiolane, 4-methyl- is C4H8S2.
What is the molecular weight of 1,3-Dithiolane, 4-methyl-?
The molecular weight of 1,3-Dithiolane, 4-methyl- is 120.006744 g/mol.
Where can I buy 1,3-Dithiolane, 4-methyl-?
You can request a quote for 1,3-Dithiolane, 4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dithiolane, 4-methyl-?
Yes, CoreyChem provides custom synthesis services for 1,3-Dithiolane, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.