1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-
TL;DR: 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- (CAS 83521-77-1) is a chemical compound with molecular formula C9H18OS2 and molecular weight 206.07991 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-pentan-2-yl-1,3-dithiolan-4-yl)methanol
Also Known As: 2-(1-Methylbutyl)-1,3-dithiolane-4-methanol, (2-pentan-2-yl-1,3-dithiolan-4-yl)methanol, 1,3-DITHIOLANE-4-METHANOL, 2-(1-METHYLBUTYL)-, [2-(pentan-2-yl)-1,3-dithiolan-4-yl]methanol, BRN 5493119
Technical Specifications
| Molecular Formula | C9H18OS2 |
| Molecular Weight | 206.07991 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.07991 Da |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
| SMILES | CCCC(C)C1SCC(S1)CO |
| InChIKey | DIHLVCHMEZLKHC-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-
Property Insights of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-
The XLogP value of 3.1 indicates that 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-. Following Lipinski's Rule of Five, 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- has 1 hydrogen bond donor(s) and 3 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-methanol, 2-(1-methylbutyl)-?
The CAS number of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- is 83521-77-1.
What is the molecular formula of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-?
The molecular formula of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- is C9H18OS2.
What is the molecular weight of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-?
The molecular weight of 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- is 206.07991 g/mol.
Where can I buy 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-?
You can request a quote for 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)-?
Yes, CoreyChem provides custom synthesis services for 1,3-Dithiolane-4-methanol, 2-(1-methylbutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.