8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one
TL;DR: 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one (CAS 100560-66-5) is a chemical compound with molecular formula C12H12O4 and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-hydroxy-6-methoxy-3,4-dimethylisochromen-1-one
Also Known As: Polygonolide, 8-hydroxy-6-methoxy-3,4-dimethylisochromen-1-one, J2.379.827A, 8-Hydroxy-6-methoxy-3,4-dimethyl-1H-2-benzopyran-1-one, 8-hydroxy-6-methoxy-3,4-dimethyl-isochromen-1-one
| Molecular Formula | C12H12O4 |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 2.12404 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.07356 |
| Heavy Atoms | 16 |
| Complexity | 610.42535 |
Chemical Identifiers
| CAS Number | 100560-66-5 |
|---|---|
| SMILES | CC1=C(OC(=O)C2=C1C=C(C=C2O)OC)C |
Product Overview
8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one (CAS 100560-66-5), with molecular formula C12H12O4 and molecular weight 220.07 g/mol. IUPAC: 8-hydroxy-6-methoxy-3,4-dimethylisochromen-1-one.
Chemical Property Profile of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one
Property Insights of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one
The XLogP value of 2.12404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one. With a topological polar surface area (TPSA) of 59.67 Ų, 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one 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 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one?
The CAS number of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one is 100560-66-5.
What is the molecular formula of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one?
The molecular formula of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one is C12H12O4.
What is the molecular weight of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one?
The molecular weight of 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one is 220.07 g/mol.
Where can I buy 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one?
You can request a quote for 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Hydroxy-6-methoxy-3,4-dimethylisochromen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.