1,3-Oxathiolane, 2,5-dimethyl-, cis-
TL;DR: 1,3-Oxathiolane, 2,5-dimethyl-, cis- (CAS 54339-86-5) is a chemical compound with molecular formula C5H10OS and molecular weight 118.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-1,3-oxathiolane
Also Known As: 2,5-dimethyl-[1,3]oxathiolane, 2,5-dimethyl-1,3-oxathiolane, 1,3-Oxathiolane, 2,5-dimethyl-, cis-
| Molecular Formula | C5H10OS |
|---|---|
| Molecular Weight | 118.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 118.045235 |
| Heavy Atoms | 7 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 54339-86-5 |
|---|---|
| SMILES | CC1CSC(O1)C |
| InChIKey | HLLCFXLPRUGRGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Oxathiolane, 2,5-dimethyl-, cis- (CAS 54339-86-5), with molecular formula C5H10OS and molecular weight 118.05 g/mol. IUPAC: 2,5-dimethyl-1,3-oxathiolane.
Chemical Property Profile of 1,3-Oxathiolane, 2,5-dimethyl-, cis-
Property Insights of 1,3-Oxathiolane, 2,5-dimethyl-, cis-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Oxathiolane, 2,5-dimethyl-, cis-. With a topological polar surface area (TPSA) of 34.5 Ų, 1,3-Oxathiolane, 2,5-dimethyl-, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Oxathiolane, 2,5-dimethyl-, cis- 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 1,3-Oxathiolane, 2,5-dimethyl-, cis-?
The CAS number of 1,3-Oxathiolane, 2,5-dimethyl-, cis- is 54339-86-5.
What is the molecular formula of 1,3-Oxathiolane, 2,5-dimethyl-, cis-?
The molecular formula of 1,3-Oxathiolane, 2,5-dimethyl-, cis- is C5H10OS.
What is the molecular weight of 1,3-Oxathiolane, 2,5-dimethyl-, cis-?
The molecular weight of 1,3-Oxathiolane, 2,5-dimethyl-, cis- is 118.05 g/mol.
Where can I buy 1,3-Oxathiolane, 2,5-dimethyl-, cis-?
You can request a quote for 1,3-Oxathiolane, 2,5-dimethyl-, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Oxathiolane, 2,5-dimethyl-, cis-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Oxathiolane, 2,5-dimethyl-, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.