绵马酚
TL;DR: 绵马酚 (CAS 519-40-4) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
绵马酚
1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)butan-1-one
Also Known As: Aspidinol, Aspidinol B, aspidinol-B, ASPIDINOL [MI], starbld0003668
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 519-40-4 |
|---|---|
| SMILES | CCCC(=O)C1=C(C(=C(C=C1O)OC)C)O |
| InChIKey | GJRJTYFSORWKBE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
绵马酚 (CAS 519-40-4), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)butan-1-one.
Chemical Property Profile of 绵马酚
Property Insights of 绵马酚
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 绵马酚. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 绵马酚. Following Lipinski's Rule of Five, 绵马酚 has 2 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 绵马酚?
The CAS number of 绵马酚 is 519-40-4.
What is the molecular formula of 绵马酚?
The molecular formula of 绵马酚 is C12H16O4.
What is the molecular weight of 绵马酚?
The molecular weight of 绵马酚 is 224.10 g/mol.
Where can I buy 绵马酚?
You can request a quote for 绵马酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 绵马酚?
Yes, KEHONG BIO provides custom synthesis services for 绵马酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.