丁香宁
TL;DR: 丁香宁 (CAS 480-34-2) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁香宁
5-hydroxy-7-methoxy-2-methylchromen-4-one
Also Known As: Eugenin, 5-Hydroxy-7-methoxy-2-methyl-4H-chromen-4-one, 5-Hydroxy-7-methoxy-2-methyl-4H-1-benzopyran-4-one, 5-HYDROXY-7-METHOXY-2-METHYLCHROMONE, 5-hydroxy-7-methoxy-2-methylchromen-4-one
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 297.0 |
| Melting Point | 119 - 120 °C |
Chemical Identifiers
| CAS Number | 480-34-2 |
|---|---|
| SMILES | CC1=CC(=O)C2=C(C=C(C=C2O1)OC)O |
| InChIKey | SUTUBQHKZRNZRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁香宁 (CAS 480-34-2), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: 5-hydroxy-7-methoxy-2-methylchromen-4-one.
Chemical Property Profile of 丁香宁
Property Insights of 丁香宁
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁香宁. With a topological polar surface area (TPSA) of 55.8 Ų, 丁香宁 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁香宁 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 丁香宁?
The CAS number of 丁香宁 is 480-34-2.
What is the molecular formula of 丁香宁?
The molecular formula of 丁香宁 is C11H10O4.
What is the molecular weight of 丁香宁?
The molecular weight of 丁香宁 is 206.06 g/mol.
Where can I buy 丁香宁?
You can request a quote for 丁香宁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁香宁?
Yes, KEHONG BIO provides custom synthesis services for 丁香宁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.