5-Methyl-1,3,2-dioxathiane 2-oxide
TL;DR: 5-Methyl-1,3,2-dioxathiane 2-oxide (CAS 6540-14-3) is a chemical compound with molecular formula C4H8O3S and molecular weight 136.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-1,3,2-dioxathiane 2-oxide
Also Known As: 5-methyl-1,3,2lambda4-dioxathian-2-one, 5-methyl-1,3,2-dioxathiane 2-oxide, 5-Methyltrimethylensulfit, 5-Methyl-2-oxo-1,3,2-dioxathiane, 1,3,2-Dioxathiane, 5-methyl-, 2-oxide
| Molecular Formula | C4H8O3S |
|---|---|
| Molecular Weight | 136.02 g/mol |
| LogP | 0.248 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.01941 |
| Heavy Atoms | 8 |
| Complexity | 93.45654 |
Chemical Identifiers
| CAS Number | 6540-14-3 |
|---|---|
| SMILES | CC1COS(=O)OC1 |
Product Overview
5-Methyl-1,3,2-dioxathiane 2-oxide (CAS 6540-14-3), with molecular formula C4H8O3S and molecular weight 136.02 g/mol. IUPAC: 5-methyl-1,3,2-dioxathiane 2-oxide.
Chemical Property Profile of 5-Methyl-1,3,2-dioxathiane 2-oxide
Property Insights of 5-Methyl-1,3,2-dioxathiane 2-oxide
The XLogP value of 0.248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-1,3,2-dioxathiane 2-oxide. With a topological polar surface area (TPSA) of 35.53 Ų, 5-Methyl-1,3,2-dioxathiane 2-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-1,3,2-dioxathiane 2-oxide has 0 hydrogen bond donor(s) and 3 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 5-Methyl-1,3,2-dioxathiane 2-oxide?
The CAS number of 5-Methyl-1,3,2-dioxathiane 2-oxide is 6540-14-3.
What is the molecular formula of 5-Methyl-1,3,2-dioxathiane 2-oxide?
The molecular formula of 5-Methyl-1,3,2-dioxathiane 2-oxide is C4H8O3S.
What is the molecular weight of 5-Methyl-1,3,2-dioxathiane 2-oxide?
The molecular weight of 5-Methyl-1,3,2-dioxathiane 2-oxide is 136.02 g/mol.
Where can I buy 5-Methyl-1,3,2-dioxathiane 2-oxide?
You can request a quote for 5-Methyl-1,3,2-dioxathiane 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-1,3,2-dioxathiane 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-1,3,2-dioxathiane 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.