8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
TL;DR: 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate (CAS 34016-66-5) is a chemical compound with molecular formula C17H12O6 and molecular weight 312.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-acetyl-4-methyl-2-oxochromen-7-yl) furan-2-carboxylate
Also Known As: BAS 01910901, 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate, BIM-0001659.P001, AE-641/14179040, 8-ACETYL-4-METHYL-2-OXO-2H-CHROMEN-7-YL 2-FUROATE
| Molecular Formula | C17H12O6 |
|---|---|
| Molecular Weight | 312.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 82.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.0634 |
| Heavy Atoms | 23 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 34016-66-5 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2C(=O)C)OC(=O)C3=CC=CO3 |
| InChIKey | WDPZMZYVQGRDLY-UHFFFAOYSA-N |
Product Overview
8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate (CAS 34016-66-5), with molecular formula C17H12O6 and molecular weight 312.06 g/mol. IUPAC: (8-acetyl-4-methyl-2-oxochromen-7-yl) furan-2-carboxylate.
Chemical Property Profile of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
Property Insights of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate. Following Lipinski's Rule of Five, 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate has 0 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 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
The CAS number of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is 34016-66-5.
What is the molecular formula of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
The molecular formula of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is C17H12O6.
What is the molecular weight of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
The molecular weight of 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate is 312.06 g/mol.
Where can I buy 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
You can request a quote for 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 8-acetyl-4-methyl-2-oxo-2H-chromen-7-yl furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.