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methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate
TL;DR: methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate (CAS 25816-60-8) is a chemical compound with molecular formula C15H10O4 and molecular weight 254.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-oxobenzo[f]chromene-2-carboxylate
Also Known As: methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate, methyl 3-oxobenzo[f]chromene-2-carboxylate, 3H-Naphtho[2,1-b]pyran-2-carboxylic acid, 3-oxo-, methyl ester, J2.494.690H, AE-848/32605028
| Molecular Formula | C15H10O4 |
|---|---|
| Molecular Weight | 254.06 g/mol |
| LogP | 2.7328 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.0579 |
| Heavy Atoms | 19 |
| Complexity | 845.50836 |
Chemical Identifiers
| CAS Number | 25816-60-8 |
|---|---|
| SMILES | COC(=O)C1=CC2=C(C=CC3=CC=CC=C32)OC1=O |
Product Overview
methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate (CAS 25816-60-8), with molecular formula C15H10O4 and molecular weight 254.06 g/mol. IUPAC: methyl 3-oxobenzo[f]chromene-2-carboxylate.
Chemical Property Profile of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate
Property Insights of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate
The XLogP value of 2.7328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate. With a topological polar surface area (TPSA) of 56.51 Ų, methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate 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 methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate?
The CAS number of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate is 25816-60-8.
What is the molecular formula of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate?
The molecular formula of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate is C15H10O4.
What is the molecular weight of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate?
The molecular weight of methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate is 254.06 g/mol.
Where can I buy methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate?
You can request a quote for methyl 3-oxo-3H-benzo[f]chromene-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 3-oxo-3H-benzo[f]chromene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-oxo-3H-benzo[f]chromene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.