8-Hydroxy-4-methyl-3,4-dihydroxycoumarin
TL;DR: 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin (CAS 894-76-8) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-hydroxy-4-methyl-3,4-dihydrochromen-2-one
Also Known As: 8-Hmdhc, 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin, 8-hydroxy-4-methyl-3,4-dihydrochromen-2-one, 2h-1-benzopyran-2-one, 3,4-dihydro-8-hydroxy-4-methyl-,(-)-, 8-Hydroxy-4-methyl-3,4-dihydro-2H-1-benzopyran-2-one
| Molecular Formula | C10H10O3 |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.06299 |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 894-76-8 |
|---|---|
| SMILES | CC1CC(=O)OC2=C1C=CC=C2O |
| InChIKey | MEUPTAWCOWQTAC-UHFFFAOYSA-N |
Product Overview
8-Hydroxy-4-methyl-3,4-dihydroxycoumarin (CAS 894-76-8), with molecular formula C10H10O3 and molecular weight 178.06 g/mol. IUPAC: 8-hydroxy-4-methyl-3,4-dihydrochromen-2-one.
Chemical Property Profile of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin
Property Insights of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin. With a topological polar surface area (TPSA) of 46.5 Ų, 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin has 1 hydrogen bond donor(s) and 3 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-4-methyl-3,4-dihydroxycoumarin?
The CAS number of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin is 894-76-8.
What is the molecular formula of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin?
The molecular formula of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin is C10H10O3.
What is the molecular weight of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin?
The molecular weight of 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin is 178.06 g/mol.
Where can I buy 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin?
You can request a quote for 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin?
Yes, KEHONG BIO provides custom synthesis services for 8-Hydroxy-4-methyl-3,4-dihydroxycoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.