2,6-Dimethyl-4H-pyran-4-thione
TL;DR: 2,6-Dimethyl-4H-pyran-4-thione (CAS 1004-37-1) is a chemical compound with molecular formula C7H8OS and molecular weight 140.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethylpyran-4-thione
Also Known As: 2,6-Dimethylpyran-4-thione, 2,6-Dimethyl-4H-pyran-4-thione, 2,6-Dimethyl-4-thiopyrone, 4H-Pyran-4-thione, 2,6-dimethyl-, 2,6-DIMETHYLPYRAN-4(4H)-THIONE
| Molecular Formula | C7H8OS |
|---|---|
| Molecular Weight | 140.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 41.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.02959 |
| Heavy Atoms | 9 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 1004-37-1 |
|---|---|
| SMILES | CC1=CC(=S)C=C(O1)C |
| InChIKey | RZGQBLWMLLDDKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dimethyl-4H-pyran-4-thione (CAS 1004-37-1), with molecular formula C7H8OS and molecular weight 140.03 g/mol. IUPAC: 2,6-dimethylpyran-4-thione.
Chemical Property Profile of 2,6-Dimethyl-4H-pyran-4-thione
Property Insights of 2,6-Dimethyl-4H-pyran-4-thione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethyl-4H-pyran-4-thione. With a topological polar surface area (TPSA) of 41.3 Ų, 2,6-Dimethyl-4H-pyran-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethyl-4H-pyran-4-thione 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 2,6-Dimethyl-4H-pyran-4-thione?
The CAS number of 2,6-Dimethyl-4H-pyran-4-thione is 1004-37-1.
What is the molecular formula of 2,6-Dimethyl-4H-pyran-4-thione?
The molecular formula of 2,6-Dimethyl-4H-pyran-4-thione is C7H8OS.
What is the molecular weight of 2,6-Dimethyl-4H-pyran-4-thione?
The molecular weight of 2,6-Dimethyl-4H-pyran-4-thione is 140.03 g/mol.
Where can I buy 2,6-Dimethyl-4H-pyran-4-thione?
You can request a quote for 2,6-Dimethyl-4H-pyran-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethyl-4H-pyran-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethyl-4H-pyran-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.