methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate
TL;DR: methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate (CAS 70093-11-7) is a chemical compound with molecular formula C12H10O5 and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate
Also Known As: methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate, 5-Hydroxy-4-methyl-2-oxo-2H-chromen-6-carbonsaeure-methylester, Methyl 5-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-6-carboxylate, 2H-1-Benzopyran-6-carboxylicacid, 5-hydroxy-4-methyl-2-oxo-, methyl ester, RefChem:317411
| Molecular Formula | C12H10O5 |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 1.59362 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.05283 |
| Heavy Atoms | 17 |
| Complexity | 653.72894 |
Chemical Identifiers
| CAS Number | 70093-11-7 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C(=C(C=C2)C(=O)OC)O |
Product Overview
methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate (CAS 70093-11-7), with molecular formula C12H10O5 and molecular weight 234.05 g/mol. IUPAC: methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate.
Chemical Property Profile of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate
Property Insights of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate
The XLogP value of 1.59362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate. Following Lipinski's Rule of Five, methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate has 1 hydrogen bond donor(s) and 5 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 methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate?
The CAS number of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate is 70093-11-7.
What is the molecular formula of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate?
The molecular formula of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate is C12H10O5.
What is the molecular weight of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate?
The molecular weight of methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate is 234.05 g/mol.
Where can I buy methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate?
You can request a quote for methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-hydroxy-4-methyl-2-oxochromene-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.