prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate
TL;DR: prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate (CAS 859663-82-4) is a chemical compound with molecular formula C18H14O6 and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate
Also Known As: EiM07-29457, prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate, allyl 2-((1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy)acetate, prop-2-enyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate
| Molecular Formula | C18H14O6 |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 2.7598 |
| Topological Polar Surface Area | 85.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.07904 |
| Heavy Atoms | 24 |
| Complexity | 985.87274 |
Chemical Identifiers
| CAS Number | 859663-82-4 |
|---|---|
| SMILES | C=CCOC(=O)COC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O |
Product Overview
prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate (CAS 859663-82-4), with molecular formula C18H14O6 and molecular weight 326.08 g/mol. IUPAC: prop-2-enyl 2-(1-hydroxy-9-oxoxanthen-3-yl)oxyacetate.
Chemical Property Profile of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate
Property Insights of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate
The XLogP value of 2.7598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate. The TPSA of 85.97 Ų falls within the moderate polarity range, balancing permeability and solubility for prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate. Following Lipinski's Rule of Five, prop-2-en-1-yl [(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 prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
The CAS number of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is 859663-82-4.
What is the molecular formula of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
The molecular formula of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is C18H14O6.
What is the molecular weight of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
The molecular weight of prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate is 326.08 g/mol.
Where can I buy prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
You can request a quote for prop-2-en-1-yl [(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 prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for prop-2-en-1-yl [(1-hydroxy-9-oxo-9H-xanthen-3-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.