3-(2-methylphenoxy)thiolane 1,1-dioxide
TL;DR: 3-(2-methylphenoxy)thiolane 1,1-dioxide (CAS 61604-47-5) is a chemical compound with molecular formula C11H14O3S and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenoxy)thiolane 1,1-dioxide
Also Known As: 3-(2-methylphenoxy)thiolane 1,1-dioxide, 3-(2-methylphenoxy)thiolane-1,1-dione, BAS 00617408, 3-o-Tolyloxy-tetrahydro-thiophene 1,1-dioxide, Thiophene, tetrahydro-3-(methylphenoxy)-, 1,1-dioxide
| Molecular Formula | C11H14O3S |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 1.56092 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.06636 |
| Heavy Atoms | 15 |
| Complexity | 450.65576 |
Chemical Identifiers
| CAS Number | 61604-47-5 |
|---|---|
| SMILES | CC1=CC=CC=C1OC2CCS(=O)(=O)C2 |
Product Overview
3-(2-methylphenoxy)thiolane 1,1-dioxide (CAS 61604-47-5), with molecular formula C11H14O3S and molecular weight 226.07 g/mol. IUPAC: 3-(2-methylphenoxy)thiolane 1,1-dioxide.
Chemical Property Profile of 3-(2-methylphenoxy)thiolane 1,1-dioxide
Property Insights of 3-(2-methylphenoxy)thiolane 1,1-dioxide
The XLogP value of 1.56092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-methylphenoxy)thiolane 1,1-dioxide. With a topological polar surface area (TPSA) of 43.37 Ų, 3-(2-methylphenoxy)thiolane 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-methylphenoxy)thiolane 1,1-dioxide 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 3-(2-methylphenoxy)thiolane 1,1-dioxide?
The CAS number of 3-(2-methylphenoxy)thiolane 1,1-dioxide is 61604-47-5.
What is the molecular formula of 3-(2-methylphenoxy)thiolane 1,1-dioxide?
The molecular formula of 3-(2-methylphenoxy)thiolane 1,1-dioxide is C11H14O3S.
What is the molecular weight of 3-(2-methylphenoxy)thiolane 1,1-dioxide?
The molecular weight of 3-(2-methylphenoxy)thiolane 1,1-dioxide is 226.07 g/mol.
Where can I buy 3-(2-methylphenoxy)thiolane 1,1-dioxide?
You can request a quote for 3-(2-methylphenoxy)thiolane 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-methylphenoxy)thiolane 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-methylphenoxy)thiolane 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.