2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione
TL;DR: 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione (CAS 80186-90-9) is a chemical compound with molecular formula C16H16O5 and molecular weight 288.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,5-dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione
Also Known As: Cycloalkannin, Cyclo-alkannin, Naphthazarin dimethyl-hydrofuran, NAPHTHAZARIN-DIMETHYL-HYDROFURAN HDFR, cyclo-S(O)-Ac-D-Tyr-Arg-Gly-Asp-Cys-OH
| Molecular Formula | C16H16O5 |
|---|---|
| Molecular Weight | 288.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.09976 |
| Heavy Atoms | 21 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 80186-90-9 |
|---|---|
| SMILES | CC1(CCC(O1)C2=CC(=O)C3=C(C=CC(=C3C2=O)O)O)C |
| InChIKey | ALRXDRQNAJOPCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione (CAS 80186-90-9), with molecular formula C16H16O5 and molecular weight 288.10 g/mol. IUPAC: 2-(5,5-dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione.
Chemical Property Profile of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione
Property Insights of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione. Following Lipinski's Rule of Five, 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione has 2 hydrogen bond donor(s) and 5 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-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione?
The CAS number of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione is 80186-90-9.
What is the molecular formula of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione?
The molecular formula of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione is C16H16O5.
What is the molecular weight of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione?
The molecular weight of 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione is 288.10 g/mol.
Where can I buy 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione?
You can request a quote for 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(5,5-Dimethyloxolan-2-yl)-5,8-dihydroxynaphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.