![benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate structure](/static/products/830/830352-50-6.png)
benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate
TL;DR: benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate (CAS 830352-50-6) is a chemical compound with molecular formula C22H16O6 and molecular weight 376.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate
Also Known As: EiM07-28952, benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate, benzyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate, benzyl 2-((1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy)acetate, Opera_ID_883
| Molecular Formula | C22H16O6 |
|---|---|
| Molecular Weight | 376.09 g/mol |
| LogP | 3.774 |
| Topological Polar Surface Area | 85.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.0947 |
| Heavy Atoms | 28 |
| Complexity | 1210.3384 |
Chemical Identifiers
| CAS Number | 830352-50-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)COC2=CC(=C3C(=C2)OC4=CC=CC=C4C3=O)O |
Product Overview
benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate (CAS 830352-50-6), with molecular formula C22H16O6 and molecular weight 376.09 g/mol. IUPAC: benzyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate.
Chemical Property Profile of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate
Property Insights of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate
The XLogP value of 3.774 indicates that benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.97 Ų falls within the moderate polarity range, balancing permeability and solubility for benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate. Following Lipinski's Rule of Five, benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate has 1 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 benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
The CAS number of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is 830352-50-6.
What is the molecular formula of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
The molecular formula of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is C22H16O6.
What is the molecular weight of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
The molecular weight of benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is 376.09 g/mol.
Where can I buy benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
You can request a quote for benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for benzyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.