2-Methyl-1,3-oxathiolane
TL;DR: 2-Methyl-1,3-oxathiolane (CAS 17642-74-9) is a chemical compound with molecular formula C4H8OS and molecular weight 104.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1,3-oxathiolane
Also Known As: 2-Methyl-1,3-oxathiolane, 1,3-Oxathiolane, 2-methyl-, 2-Methyl-1,3-oxothiolane, 2-methyl-[1,3]oxathiolane, RefChem:262882
| Molecular Formula | C4H8OS |
|---|---|
| Molecular Weight | 104.03 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 104.02959 |
| Heavy Atoms | 6 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 17642-74-9 |
|---|---|
| SMILES | CC1OCCS1 |
| InChIKey | QNNPPEKCYFEVCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1,3-oxathiolane (CAS 17642-74-9), with molecular formula C4H8OS and molecular weight 104.03 g/mol. IUPAC: 2-methyl-1,3-oxathiolane.
Chemical Property Profile of 2-Methyl-1,3-oxathiolane
Property Insights of 2-Methyl-1,3-oxathiolane
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1,3-oxathiolane. With a topological polar surface area (TPSA) of 34.5 Ų, 2-Methyl-1,3-oxathiolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1,3-oxathiolane 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-Methyl-1,3-oxathiolane?
The CAS number of 2-Methyl-1,3-oxathiolane is 17642-74-9.
What is the molecular formula of 2-Methyl-1,3-oxathiolane?
The molecular formula of 2-Methyl-1,3-oxathiolane is C4H8OS.
What is the molecular weight of 2-Methyl-1,3-oxathiolane?
The molecular weight of 2-Methyl-1,3-oxathiolane is 104.03 g/mol.
Where can I buy 2-Methyl-1,3-oxathiolane?
You can request a quote for 2-Methyl-1,3-oxathiolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1,3-oxathiolane?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1,3-oxathiolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.