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Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate
TL;DR: Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate (CAS 4512-55-4) is a chemical compound with molecular formula C16H12O5 and molecular weight 284.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-4,9-dioxobenzo[f][1]benzofuran-3-carboxylate
Also Known As: ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate, J2.204.221A, ethyl 2-methyl-4,9-dioxobenzo[f][1]benzofuran-3-carboxylate, 3-ethoxycarbonyl-2-methylnaphtho[2,3-b]furan-4,9-quinone, 2-methyl-4,9-dioxo-3-benzo[f]benzofurancarboxylic acid ethyl ester
| Molecular Formula | C16H12O5 |
|---|---|
| Molecular Weight | 284.07 g/mol |
| LogP | 2.54012 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.06848 |
| Heavy Atoms | 21 |
| Complexity | 781.9602 |
Chemical Identifiers
| CAS Number | 4512-55-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C(=O)C3=CC=CC=C3C2=O)C |
Product Overview
Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate (CAS 4512-55-4), with molecular formula C16H12O5 and molecular weight 284.07 g/mol. IUPAC: ethyl 2-methyl-4,9-dioxobenzo[f][1]benzofuran-3-carboxylate.
Chemical Property Profile of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate
Property Insights of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate
The XLogP value of 2.54012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate has 0 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 Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate?
The CAS number of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate is 4512-55-4.
What is the molecular formula of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate?
The molecular formula of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate is C16H12O5.
What is the molecular weight of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate?
The molecular weight of Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate is 284.07 g/mol.
Where can I buy Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate?
You can request a quote for Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]furan-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.