![Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate structure](/static/products/863/86358-30-7.png)
Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate
TL;DR: Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate (CAS 86358-30-7) is a chemical compound with molecular formula C11H10O5 and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1,3-benzodioxol-5-yl)-2-oxoacetate
Also Known As: ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate, ethyl 2-(1,3-benzodioxol-5-yl)-2-oxoacetate, ethyl 3,4-methylenedioxybenzoylformate, ETHYL 3,4-(METHYLENEDIOXY)BENZOYLFORMATE, ETHYL3,4-METHYLENEDIOXYBENZOYLFORMATE
| Molecular Formula | C11H10O5 |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 1.1611 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.05283 |
| Heavy Atoms | 16 |
| Complexity | 438.0011 |
Chemical Identifiers
| CAS Number | 86358-30-7 |
|---|---|
| SMILES | CCOC(=O)C(=O)C1=CC2=C(C=C1)OCO2 |
Product Overview
Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate (CAS 86358-30-7), with molecular formula C11H10O5 and molecular weight 222.05 g/mol. IUPAC: ethyl 2-(1,3-benzodioxol-5-yl)-2-oxoacetate.
Chemical Property Profile of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate
Property Insights of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate
The XLogP value of 1.1611 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate. Following Lipinski's Rule of Five, Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate 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-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate?
The CAS number of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate is 86358-30-7.
What is the molecular formula of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate?
The molecular formula of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate is C11H10O5.
What is the molecular weight of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate?
The molecular weight of Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate is 222.05 g/mol.
Where can I buy Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate?
You can request a quote for Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(benzo[d][1,3]dioxol-5-yl)-2-oxoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.