methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate
TL;DR: methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate (CAS 73486-45-0) is a chemical compound with molecular formula C16H12O6 and molecular weight 300.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(7-hydroxy-4-oxochromen-3-yl)-5-methylfuran-2-carboxylate
Also Known As: ZHUFEHQRVMTCSC-UHFFFAOYSA-, methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate, 7-hydroxy-3-(5-methoxycarbonyl-2-methylfuran-3-yl)chromone, methyl 4-(7-hydroxy-4-oxochromen-3-yl)-5-methylfuran-2-carboxylate, InChI=1/C16H12O6/c1-8-11(6-14(22-8)16(19)20-2)12-7-21-13-5-9(17)3-4-10(13)15(12)18/h3-7,17H,1-2H3
| Molecular Formula | C16H12O6 |
|---|---|
| Molecular Weight | 300.06 g/mol |
| LogP | 2.85362 |
| Topological Polar Surface Area | 89.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.0634 |
| Heavy Atoms | 22 |
| Complexity | 931.4493 |
Chemical Identifiers
| CAS Number | 73486-45-0 |
|---|---|
| SMILES | CC1=C(C=C(O1)C(=O)OC)C2=COC3=C(C2=O)C=CC(=C3)O |
Product Overview
methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate (CAS 73486-45-0), with molecular formula C16H12O6 and molecular weight 300.06 g/mol. IUPAC: methyl 4-(7-hydroxy-4-oxochromen-3-yl)-5-methylfuran-2-carboxylate.
Chemical Property Profile of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate
Property Insights of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate
The XLogP value of 2.85362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate. The TPSA of 89.88 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate. Following Lipinski's Rule of Five, methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate has 1 hydrogen bond donor(s) and 6 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 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate?
The CAS number of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate is 73486-45-0.
What is the molecular formula of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate?
The molecular formula of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate is C16H12O6.
What is the molecular weight of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate?
The molecular weight of methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate is 300.06 g/mol.
Where can I buy methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate?
You can request a quote for methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(7-hydroxy-4-oxo-4H-chromen-3-yl)-5-methylfuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.