5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione
TL;DR: 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione (CAS 41768-13-2) is a chemical compound with molecular formula C11H10O6 and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7,8-tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione
Also Known As: 6,7-Dihydro-2,3,5,8-tetrahydroxy-6-methyl-1,4-naphthalenedione, 5,6,7,8-tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione, 1,4-NAPHTHALENEDIONE, 6,7-DIHYDRO-2,3,5,8-TETRAHYDROXY-6-METHYL-, 2,3,5,8-tetrahydroxy-6-methyl-1,4,6,7-tetrahydronaphthalene-1,4-dione, RefChem:1072168
| Molecular Formula | C11H10O6 |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.04774 |
| Heavy Atoms | 17 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 41768-13-2 |
|---|---|
| SMILES | CC1CC(=O)C2=C(C1=O)C(=C(C(=C2O)O)O)O |
| InChIKey | HXOOOGYEHMTSBK-UHFFFAOYSA-N |
Product Overview
5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione (CAS 41768-13-2), with molecular formula C11H10O6 and molecular weight 238.05 g/mol. IUPAC: 5,6,7,8-tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione.
Chemical Property Profile of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione
Property Insights of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione has 4 hydrogen bond donor(s) and 6 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 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione?
The CAS number of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione is 41768-13-2.
What is the molecular formula of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione?
The molecular formula of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione is C11H10O6.
What is the molecular weight of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione?
The molecular weight of 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione is 238.05 g/mol.
Where can I buy 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione?
You can request a quote for 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-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 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7,8-Tetrahydroxy-2-methyl-2,3-dihydronaphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.