4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate
TL;DR: 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate (CAS 499141-36-5) is a chemical compound with molecular formula C15H14O4 and molecular weight 258.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-2-oxochromen-7-yl) cyclobutanecarboxylate
Also Known As: 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate, J2.140.682A, (4-methyl-2-oxochromen-7-yl) cyclobutanecarboxylate, AO-548/40962978, Cyclobutanecarboxylic acid 2-oxo-4-methyl-2H-1-benzopyran-7-yl ester
| Molecular Formula | C15H14O4 |
|---|---|
| Molecular Weight | 258.09 g/mol |
| LogP | 2.80692 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.0892 |
| Heavy Atoms | 19 |
| Complexity | 694.8481 |
Chemical Identifiers
| CAS Number | 499141-36-5 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCC3 |
Product Overview
4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate (CAS 499141-36-5), with molecular formula C15H14O4 and molecular weight 258.09 g/mol. IUPAC: (4-methyl-2-oxochromen-7-yl) cyclobutanecarboxylate.
Chemical Property Profile of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate
Property Insights of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate
The XLogP value of 2.80692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate. With a topological polar surface area (TPSA) of 56.51 Ų, 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate has 0 hydrogen bond donor(s) and 4 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 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate?
The CAS number of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate is 499141-36-5.
What is the molecular formula of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate?
The molecular formula of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate is C15H14O4.
What is the molecular weight of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate?
The molecular weight of 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate is 258.09 g/mol.
Where can I buy 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate?
You can request a quote for 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2-oxo-2H-chromen-7-yl cyclobutanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.