Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate
TL;DR: Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate (CAS 57134-55-1) is a chemical compound with molecular formula C12H12O4 and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (Z)-3-(1,3-benzodioxol-5-yl)prop-2-enoate
Also Known As: null, Ethyl piperonylideneacetate, EINECS 260-585-5, Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate, ethyl (Z)-3-(1,3-benzodioxol-5-yl)prop-2-enoate
| Molecular Formula | C12H12O4 |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 1.9916 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.07356 |
| Heavy Atoms | 16 |
| Complexity | 423.02698 |
Chemical Identifiers
| CAS Number | 57134-55-1 |
|---|---|
| SMILES | CCOC(=O)/C=C\C1=CC2=C(C=C1)OCO2 |
Product Overview
Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate (CAS 57134-55-1), with molecular formula C12H12O4 and molecular weight 220.07 g/mol. IUPAC: ethyl (Z)-3-(1,3-benzodioxol-5-yl)prop-2-enoate.
Chemical Property Profile of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate
Property Insights of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate
The XLogP value of 1.9916 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate. With a topological polar surface area (TPSA) of 44.76 Ų, Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate has 0 hydrogen bond donor(s) and 4 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 (Z)-3-(1,3-benzodioxol-5-yl)acrylate?
The CAS number of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate is 57134-55-1.
What is the molecular formula of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate?
The molecular formula of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate is C12H12O4.
What is the molecular weight of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate?
The molecular weight of Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate is 220.07 g/mol.
Where can I buy Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate?
You can request a quote for Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (Z)-3-(1,3-benzodioxol-5-yl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.