Ethyl(phenylazo)malononitrile
TL;DR: Ethyl(phenylazo)malononitrile (CAS 3655-96-7) is a chemical compound with molecular formula C11H10N4 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenyldiazenylethyl)propanedinitrile
Also Known As: Ethyl(phenylazo)malononitrile, Phenyl-azo-aethyl-malonitril, Phenyl-azo-aethyl-malonitril [German], MALONONITRILE, ETHYL(PHENYLAZO)-, F 2287
| Molecular Formula | C11H10N4 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.09055 |
| Heavy Atoms | 15 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 3655-96-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=NCCC(C#N)C#N |
| InChIKey | MDQGNSZLYUMIJL-UHFFFAOYSA-N |
Product Overview
Ethyl(phenylazo)malononitrile (CAS 3655-96-7), with molecular formula C11H10N4 and molecular weight 198.09 g/mol. IUPAC: 2-(2-phenyldiazenylethyl)propanedinitrile.
Chemical Property Profile of Ethyl(phenylazo)malononitrile
Property Insights of Ethyl(phenylazo)malononitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl(phenylazo)malononitrile. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl(phenylazo)malononitrile. Following Lipinski's Rule of Five, Ethyl(phenylazo)malononitrile 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(phenylazo)malononitrile?
The CAS number of Ethyl(phenylazo)malononitrile is 3655-96-7.
What is the molecular formula of Ethyl(phenylazo)malononitrile?
The molecular formula of Ethyl(phenylazo)malononitrile is C11H10N4.
What is the molecular weight of Ethyl(phenylazo)malononitrile?
The molecular weight of Ethyl(phenylazo)malononitrile is 198.09 g/mol.
Where can I buy Ethyl(phenylazo)malononitrile?
You can request a quote for Ethyl(phenylazo)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl(phenylazo)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for Ethyl(phenylazo)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.