2,2,6-Trimethylthiochromene 1-oxide
TL;DR: 2,2,6-Trimethylthiochromene 1-oxide (CAS 124769-21-7) is a chemical compound with molecular formula C12H14OS and molecular weight 206.07654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,6-trimethylthiochromene 1-oxide
Also Known As: 2,2,6-trimethylthiochromene 1-oxide, 2,2,6-trimethyl-2H-thiochromene 1-oxide, 2,2,6-Trimethyl-2H-1benzothiopyran-1-oxide, 2,2,6-trimethyl-1-benzothiopyran 1-oxide, 2,2,6-Trimethyl-1-benzothiopyran-1(2H)-one
Technical Specifications
| Molecular Formula | C12H14OS |
| Molecular Weight | 206.07654 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.07654 Da |
| Heavy Atoms | 14 |
| Complexity | 280.0 |
| SMILES | CC1=CC2=C(C=C1)S(=O)C(C=C2)(C)C |
| InChIKey | OWRDGESCAWHHGA-UHFFFAOYSA-N |
Chemical Property Profile of 2,2,6-Trimethylthiochromene 1-oxide
Property Insights of 2,2,6-Trimethylthiochromene 1-oxide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,6-Trimethylthiochromene 1-oxide. With a topological polar surface area (TPSA) of 36.3 Ų, 2,2,6-Trimethylthiochromene 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,6-Trimethylthiochromene 1-oxide 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
What is the CAS number of 2,2,6-Trimethylthiochromene 1-oxide?
The CAS number of 2,2,6-Trimethylthiochromene 1-oxide is 124769-21-7.
What is the molecular formula of 2,2,6-Trimethylthiochromene 1-oxide?
The molecular formula of 2,2,6-Trimethylthiochromene 1-oxide is C12H14OS.
What is the molecular weight of 2,2,6-Trimethylthiochromene 1-oxide?
The molecular weight of 2,2,6-Trimethylthiochromene 1-oxide is 206.07654 g/mol.
Where can I buy 2,2,6-Trimethylthiochromene 1-oxide?
You can request a quote for 2,2,6-Trimethylthiochromene 1-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2,6-Trimethylthiochromene 1-oxide?
Yes, CoreyChem provides custom synthesis services for 2,2,6-Trimethylthiochromene 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.