![ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate structure](/static/products/4497/449787-29-5.webp)
ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate
TL;DR: ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate (CAS 449787-29-5) is a chemical compound with molecular formula C14H13ClO5 and molecular weight 296.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-chloro-4-methyl-2-oxochromen-7-yl)oxyacetate
Also Known As: ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate, ethyl 2-(3-chloro-4-methyl-2-oxochromen-7-yl)oxyacetate
| Molecular Formula | C14H13ClO5 |
|---|---|
| Molecular Weight | 296.05 g/mol |
| LogP | 2.69672 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.04517 |
| Heavy Atoms | 20 |
| Complexity | 704.51184 |
Chemical Identifiers
| CAS Number | 449787-29-5 |
|---|---|
| SMILES | CCOC(=O)COC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C |
Product Overview
ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate (CAS 449787-29-5), with molecular formula C14H13ClO5 and molecular weight 296.05 g/mol. IUPAC: ethyl 2-(3-chloro-4-methyl-2-oxochromen-7-yl)oxyacetate.
Chemical Property Profile of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate
Property Insights of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate
The XLogP value of 2.69672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate. Following Lipinski's Rule of Five, ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate has 0 hydrogen bond donor(s) and 5 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 ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate?
The CAS number of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate is 449787-29-5.
What is the molecular formula of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate?
The molecular formula of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate is C14H13ClO5.
What is the molecular weight of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate?
The molecular weight of ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate is 296.05 g/mol.
Where can I buy ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate?
You can request a quote for ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-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 ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(3-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.