2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate
TL;DR: 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate (CAS 692264-89-4) is a chemical compound with molecular formula C22H22O7 and molecular weight 398.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxochromen-4-yl) 3,4,5-triethoxybenzoate
Also Known As: ChemDiv2_001319, 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate, (2-oxochromen-4-yl) 3,4,5-triethoxybenzoate, AO-365/41546486
| Molecular Formula | C22H22O7 |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | 4.2083 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 398.13657 |
| Heavy Atoms | 29 |
| Complexity | 1041.1841 |
Chemical Identifiers
| CAS Number | 692264-89-4 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC(=O)OC3=CC=CC=C32 |
Product Overview
2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate (CAS 692264-89-4), with molecular formula C22H22O7 and molecular weight 398.14 g/mol. IUPAC: (2-oxochromen-4-yl) 3,4,5-triethoxybenzoate.
Chemical Property Profile of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate
Property Insights of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate
The XLogP value of 4.2083 indicates that 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate. Following Lipinski's Rule of Five, 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate has 0 hydrogen bond donor(s) and 7 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 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate?
The CAS number of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate is 692264-89-4.
What is the molecular formula of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate?
The molecular formula of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate is C22H22O7.
What is the molecular weight of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate?
The molecular weight of 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate is 398.14 g/mol.
Where can I buy 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate?
You can request a quote for 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2H-chromen-4-yl 3,4,5-triethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.