扁枝衣二酸
TL;DR: 扁枝衣二酸 (CAS 537-09-7) is a chemical compound with molecular formula C17H16O7 and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
扁枝衣二酸
2-hydroxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoic acid
Also Known As: Evernic acid, Evernsaure, Evernic acid, pruiss, EVERNICACID, Lecanoric acid methyl ether
| Molecular Formula | C17H16O7 |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.0896 |
| Heavy Atoms | 24 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 537-09-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C(=O)OC2=CC(=C(C(=C2)C)C(=O)O)O)O)OC |
| InChIKey | GODLCSLPZIBRMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
扁枝衣二酸 (CAS 537-09-7), with molecular formula C17H16O7 and molecular weight 332.09 g/mol. IUPAC: 2-hydroxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoic acid.
Chemical Property Profile of 扁枝衣二酸
Property Insights of 扁枝衣二酸
The XLogP value of 4.0 indicates that 扁枝衣二酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 扁枝衣二酸. Following Lipinski's Rule of Five, 扁枝衣二酸 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 扁枝衣二酸?
The CAS number of 扁枝衣二酸 is 537-09-7.
What is the molecular formula of 扁枝衣二酸?
The molecular formula of 扁枝衣二酸 is C17H16O7.
What is the molecular weight of 扁枝衣二酸?
The molecular weight of 扁枝衣二酸 is 332.09 g/mol.
Where can I buy 扁枝衣二酸?
You can request a quote for 扁枝衣二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 扁枝衣二酸?
Yes, KEHONG BIO provides custom synthesis services for 扁枝衣二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.