6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione
TL;DR: 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione (CAS 15254-72-5) is a chemical compound with molecular formula C13H10O7 and molecular weight 278.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione
Also Known As: 6-acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione, 3-Acetyl-2-hydroxy-7-methoxynaphthazarin, 2-Acetyl-3,5,8-trihydroxy-6-methoxy-1,4-naphthalenedione, 2-Acetyl-3,5,8-trihydroxy-6-methoxynaphthoquinone, 1,4-Naphthoquinone, 2-acetyl-3,5,8-trihydroxy-6-methoxy-
| Molecular Formula | C13H10O7 |
|---|---|
| Molecular Weight | 278.04 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.04266 |
| Heavy Atoms | 20 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 15254-72-5 |
|---|---|
| SMILES | CC(=O)C1=C(C2=C(C(=C1O)O)C(=O)C(=CC2=O)OC)O |
| InChIKey | GEOIFUNYZMDHEN-UHFFFAOYSA-N |
Product Overview
6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione (CAS 15254-72-5), with molecular formula C13H10O7 and molecular weight 278.04 g/mol. IUPAC: 6-acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione.
Chemical Property Profile of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione
Property Insights of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione. Following Lipinski's Rule of Five, 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione has 3 hydrogen bond donor(s) and 7 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 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione?
The CAS number of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione is 15254-72-5.
What is the molecular formula of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione?
The molecular formula of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione is C13H10O7.
What is the molecular weight of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione?
The molecular weight of 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione is 278.04 g/mol.
Where can I buy 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione?
You can request a quote for 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-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 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Acetyl-5,7,8-trihydroxy-2-methoxynaphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.