Vinyl dicyanoacetate
TL;DR: Vinyl dicyanoacetate (CAS 71607-35-7) is a chemical compound with molecular formula C6H4N2O2 and molecular weight 136.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl 2,2-dicyanoacetate
Also Known As: Vinyl dicyanoacetate, ethenyl 2,2-dicyanoacetate, Ethenyl dicyanoacetate, Vinyl 2,2-dicyanoacetate, EINECS 275-676-5
| Molecular Formula | C6H4N2O2 |
|---|---|
| Molecular Weight | 136.03 g/mol |
| LogP | 0.33646 |
| Topological Polar Surface Area | 73.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.02728 |
| Heavy Atoms | 10 |
| Complexity | 206.88277 |
Chemical Identifiers
| CAS Number | 71607-35-7 |
|---|---|
| SMILES | C=COC(=O)C(C#N)C#N |
Product Overview
Vinyl dicyanoacetate (CAS 71607-35-7), with molecular formula C6H4N2O2 and molecular weight 136.03 g/mol. IUPAC: ethenyl 2,2-dicyanoacetate.
Chemical Property Profile of Vinyl dicyanoacetate
Property Insights of Vinyl dicyanoacetate
The XLogP value of 0.33646 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vinyl dicyanoacetate. The TPSA of 73.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Vinyl dicyanoacetate. Following Lipinski's Rule of Five, Vinyl dicyanoacetate 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 Vinyl dicyanoacetate?
The CAS number of Vinyl dicyanoacetate is 71607-35-7.
What is the molecular formula of Vinyl dicyanoacetate?
The molecular formula of Vinyl dicyanoacetate is C6H4N2O2.
What is the molecular weight of Vinyl dicyanoacetate?
The molecular weight of Vinyl dicyanoacetate is 136.03 g/mol.
Where can I buy Vinyl dicyanoacetate?
You can request a quote for Vinyl dicyanoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vinyl dicyanoacetate?
Yes, KEHONG BIO provides custom synthesis services for Vinyl dicyanoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.