![Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester structure](/static/products/405/40547-31-7.png)
Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester
TL;DR: Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester (CAS 40547-31-7) is a chemical compound with molecular formula C17H14O6 and molecular weight 314.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate
Also Known As: ethyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate, ethyl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate, ethyl 2-((1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy)acetate, Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester, Acetic acid,[(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-,ethyl ester
| Molecular Formula | C17H14O6 |
|---|---|
| Molecular Weight | 314.08 g/mol |
| LogP | 2.5937 |
| Topological Polar Surface Area | 85.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.07904 |
| Heavy Atoms | 23 |
| Complexity | 940.8601 |
Chemical Identifiers
| CAS Number | 40547-31-7 |
|---|---|
| SMILES | CCOC(=O)COC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O |
Product Overview
Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester (CAS 40547-31-7), with molecular formula C17H14O6 and molecular weight 314.08 g/mol. IUPAC: ethyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate.
Chemical Property Profile of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester
Property Insights of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester
The XLogP value of 2.5937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester. The TPSA of 85.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester 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 Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester?
The CAS number of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester is 40547-31-7.
What is the molecular formula of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester?
The molecular formula of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester is C17H14O6.
What is the molecular weight of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester?
The molecular weight of Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester is 314.08 g/mol.
Where can I buy Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester?
You can request a quote for Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.