6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one
TL;DR: 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one (CAS 6089-66-3) is a chemical compound with molecular formula C12H12O3 and molecular weight 204.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-7-hydroxy-4-methylchromen-2-one
Also Known As: 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one, Benzyltiglate, 6-ethyl-7-hydroxy-4-methylchromen-2-one, 6-ethyl-7-hydroxy-4-methylcoumarin, 2H-1-Benzopyran-2-one, 6-ethyl-7-hydroxy-4-methyl-
| Molecular Formula | C12H12O3 |
|---|---|
| Molecular Weight | 204.08 g/mol |
| LogP | 2.36942 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.07864 |
| Heavy Atoms | 15 |
| Complexity | 566.82434 |
Chemical Identifiers
| CAS Number | 6089-66-3 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1O)OC(=O)C=C2C |
Product Overview
6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one (CAS 6089-66-3), with molecular formula C12H12O3 and molecular weight 204.08 g/mol. IUPAC: 6-ethyl-7-hydroxy-4-methylchromen-2-one.
Chemical Property Profile of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one
Property Insights of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one
The XLogP value of 2.36942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one. With a topological polar surface area (TPSA) of 50.44 Ų, 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one 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 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one?
The CAS number of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one is 6089-66-3.
What is the molecular formula of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one?
The molecular formula of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one is C12H12O3.
What is the molecular weight of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one?
The molecular weight of 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one is 204.08 g/mol.
Where can I buy 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one?
You can request a quote for 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-ethyl-7-hydroxy-4-methyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.