2,6-Dimethyloxin-4-ol
TL;DR: 2,6-Dimethyloxin-4-ol (CAS 41463-78-9) is a chemical compound with molecular formula C7H9O2+ and molecular weight 125.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dimethylpyran-4-ylidene)oxidanium
Also Known As: 2,6-dimethyloxin-4-ol, 2,6-Dimethyl-4-hydroxypyrylium, 4-hydroxy-2,6-dimethyl-pyranylium, 2,6-dimethyl-4-hydroxypyrylium cation, (2,6-dimethylpyran-4-ylidene)oxidanium
| Molecular Formula | C7H9O2+ |
|---|---|
| Molecular Weight | 125.06 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 10.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.06026 |
| Heavy Atoms | 9 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 41463-78-9 |
|---|---|
| SMILES | CC1=CC(=[OH+])C=C(O1)C |
| InChIKey | VSYFZULSKMFUJJ-UHFFFAOYSA-O |
Product Overview
2,6-Dimethyloxin-4-ol (CAS 41463-78-9), with molecular formula C7H9O2+ and molecular weight 125.06 g/mol. IUPAC: (2,6-dimethylpyran-4-ylidene)oxidanium.
Chemical Property Profile of 2,6-Dimethyloxin-4-ol
Property Insights of 2,6-Dimethyloxin-4-ol
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethyloxin-4-ol. With a topological polar surface area (TPSA) of 10.2 Ų, 2,6-Dimethyloxin-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethyloxin-4-ol has 1 hydrogen bond donor(s) and 1 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-Dimethyloxin-4-ol?
The CAS number of 2,6-Dimethyloxin-4-ol is 41463-78-9.
What is the molecular formula of 2,6-Dimethyloxin-4-ol?
The molecular formula of 2,6-Dimethyloxin-4-ol is C7H9O2+.
What is the molecular weight of 2,6-Dimethyloxin-4-ol?
The molecular weight of 2,6-Dimethyloxin-4-ol is 125.06 g/mol.
Where can I buy 2,6-Dimethyloxin-4-ol?
You can request a quote for 2,6-Dimethyloxin-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethyloxin-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethyloxin-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.