![Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate structure](/static/products/893/893765-60-1.png)
Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate
TL;DR: Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate (CAS 893765-60-1) is a chemical compound with molecular formula C11H11NO7 and molecular weight 269.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate
Also Known As: ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate, Ethyl 2-((6-nitrobenzo[d][1,3]dioxol-5-yl)oxy)acetate, ethyl 2-[(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate, Ethyl (6-nitro-1,3-benzodioxol-5-yl)oxyacetate, ethyl [(6-nitrobenzo[1,3]dioxol-5-yl)oxy]acetate
| Molecular Formula | C11H11NO7 |
|---|---|
| Molecular Weight | 269.05 g/mol |
| LogP | 1.2654 |
| Topological Polar Surface Area | 97.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 269.05356 |
| Heavy Atoms | 19 |
| Complexity | 514.0103 |
Chemical Identifiers
| CAS Number | 893765-60-1 |
|---|---|
| SMILES | CCOC(=O)COC1=CC2=C(C=C1[N+](=O)[O-])OCO2 |
Product Overview
Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate (CAS 893765-60-1), with molecular formula C11H11NO7 and molecular weight 269.05 g/mol. IUPAC: ethyl 2-[(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate.
Chemical Property Profile of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate
Property Insights of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate
The XLogP value of 1.2654 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate. The TPSA of 97.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate. Following Lipinski's Rule of Five, Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate 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 Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate?
The CAS number of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate is 893765-60-1.
What is the molecular formula of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate?
The molecular formula of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate is C11H11NO7.
What is the molecular weight of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate?
The molecular weight of Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate is 269.05 g/mol.
Where can I buy Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate?
You can request a quote for Ethyl [(6-nitro-1,3-benzodioxol-5-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 [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(6-nitro-1,3-benzodioxol-5-yl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.