2-Methoxy-7-Methyljuglone
TL;DR: 2-Methoxy-7-Methyljuglone (CAS 39058-18-9) is a chemical compound with molecular formula C12H10O4 and molecular weight 218.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-2-methoxy-7-methylnaphthalene-1,4-dione
Also Known As: 2-methoxy-7-methyljuglone, 5-hydroxy-2-methoxy-7-methyl-1,4-naphthoquinone, 5-hydroxy-2-methoxy-7-methylnaphthalene-1,4-dione, 5-Hydroxy-2-methoxy-7-methyl-[1,4]naphthoquinone, 2-Methoxy-5-hydroxy-7-methyl-1,4-naphthoquinone
| Molecular Formula | C12H10O4 |
|---|---|
| Molecular Weight | 218.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.0579 |
| Heavy Atoms | 16 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 39058-18-9 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)O)C(=O)C=C(C2=O)OC |
| InChIKey | HBAYLNVMQQHPOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxy-7-Methyljuglone (CAS 39058-18-9), with molecular formula C12H10O4 and molecular weight 218.06 g/mol. IUPAC: 5-hydroxy-2-methoxy-7-methylnaphthalene-1,4-dione.
Chemical Property Profile of 2-Methoxy-7-Methyljuglone
Property Insights of 2-Methoxy-7-Methyljuglone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-7-Methyljuglone. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-7-Methyljuglone. Following Lipinski's Rule of Five, 2-Methoxy-7-Methyljuglone has 1 hydrogen bond donor(s) and 4 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-Methoxy-7-Methyljuglone?
The CAS number of 2-Methoxy-7-Methyljuglone is 39058-18-9.
What is the molecular formula of 2-Methoxy-7-Methyljuglone?
The molecular formula of 2-Methoxy-7-Methyljuglone is C12H10O4.
What is the molecular weight of 2-Methoxy-7-Methyljuglone?
The molecular weight of 2-Methoxy-7-Methyljuglone is 218.06 g/mol.
Where can I buy 2-Methoxy-7-Methyljuglone?
You can request a quote for 2-Methoxy-7-Methyljuglone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-7-Methyljuglone?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-7-Methyljuglone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.