4-oxo-2-phenyl-4H-chromen-3-yl benzoate
TL;DR: 4-oxo-2-phenyl-4H-chromen-3-yl benzoate (CAS 22812-29-9) is a chemical compound with molecular formula C22H14O4 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-2-phenylchromen-3-yl) benzoate
Also Known As: 3-Benzoyloxy flavone, Antibiofilm agent-10, 4-oxo-2-phenyl-4H-chromen-3-yl benzoate, (4-oxo-2-phenylchromen-3-yl) benzoate, 4-oxo-2-phenylchromen-3-yl benzoate
| Molecular Formula | C22H14O4 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.0892 |
| Heavy Atoms | 26 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 22812-29-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC=CC=C4 |
| InChIKey | MTHWZCUSVZVBSA-UHFFFAOYSA-N |
Product Overview
4-oxo-2-phenyl-4H-chromen-3-yl benzoate (CAS 22812-29-9), with molecular formula C22H14O4 and molecular weight 342.09 g/mol. IUPAC: (4-oxo-2-phenylchromen-3-yl) benzoate.
Chemical Property Profile of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate
Property Insights of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate
The XLogP value of 5.2 indicates that 4-oxo-2-phenyl-4H-chromen-3-yl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 4-oxo-2-phenyl-4H-chromen-3-yl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-oxo-2-phenyl-4H-chromen-3-yl benzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate?
The CAS number of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate is 22812-29-9.
What is the molecular formula of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate?
The molecular formula of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate is C22H14O4.
What is the molecular weight of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate?
The molecular weight of 4-oxo-2-phenyl-4H-chromen-3-yl benzoate is 342.09 g/mol.
Where can I buy 4-oxo-2-phenyl-4H-chromen-3-yl benzoate?
You can request a quote for 4-oxo-2-phenyl-4H-chromen-3-yl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-2-phenyl-4H-chromen-3-yl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-2-phenyl-4H-chromen-3-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.