松蘿酸
TL;DR: 松蘿酸 (CAS 125-46-2) is a chemical compound with molecular formula C18H16O7 and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
松蘿酸
2,6-diacetyl-7,9-dihydroxy-8,9b-dimethyldibenzofuran-1,3-dione
Also Known As: usnic acid, Usniacin, Usnein, Usninic acid, Usno
| Molecular Formula | C18H16O7 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.0896 |
| Heavy Atoms | 25 |
| Complexity | 708.0 |
| Melting Point | 204 °C |
| Solubility | Solubility at 25 °C (g/100 ml): acetone, 0.77; ethyl acetate, 0.88; fural, 7.32; furfuryl alcohol, 1.21 |
Chemical Identifiers
| CAS Number | 125-46-2 |
|---|---|
| SMILES | CC1=C(C(=C2C(=C1O)C3(C(=CC(=O)C(C3=O)C(=O)C)O2)C)C(=O)C)O |
| InChIKey | CUCUKLJLRRAKFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
松蘿酸 (CAS 125-46-2), with molecular formula C18H16O7 and molecular weight 344.09 g/mol. IUPAC: 2,6-diacetyl-7,9-dihydroxy-8,9b-dimethyldibenzofuran-1,3-dione.
Chemical Property Profile of 松蘿酸
Property Insights of 松蘿酸
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 松蘿酸. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 松蘿酸. Following Lipinski's Rule of Five, 松蘿酸 has 2 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 松蘿酸?
The CAS number of 松蘿酸 is 125-46-2.
What is the molecular formula of 松蘿酸?
The molecular formula of 松蘿酸 is C18H16O7.
What is the molecular weight of 松蘿酸?
The molecular weight of 松蘿酸 is 344.09 g/mol.
Where can I buy 松蘿酸?
You can request a quote for 松蘿酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 松蘿酸?
Yes, KEHONG BIO provides custom synthesis services for 松蘿酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.