Ethyl(m-tolylazo)malononitrile
TL;DR: Ethyl(m-tolylazo)malononitrile (CAS 3655-98-9) is a chemical compound with molecular formula C12H12N4 and molecular weight 212.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(3-methylphenyl)diazenyl]ethyl]propanedinitrile
Also Known As: Ethyl(m-tolylazo)malononitrile, 3-Tolyl-azo-aethyl-malonitril, 3-Tolyl-azo-aethyl-malonitril [German], MALONONITRILE, ETHYL(m-TOLYLAZO)-, F 2289
| Molecular Formula | C12H12N4 |
|---|---|
| Molecular Weight | 212.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.1062 |
| Heavy Atoms | 16 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 3655-98-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N=NCCC(C#N)C#N |
| InChIKey | RHVMVHCLFXANBP-UHFFFAOYSA-N |
Product Overview
Ethyl(m-tolylazo)malononitrile (CAS 3655-98-9), with molecular formula C12H12N4 and molecular weight 212.11 g/mol. IUPAC: 2-[2-[(3-methylphenyl)diazenyl]ethyl]propanedinitrile.
Chemical Property Profile of Ethyl(m-tolylazo)malononitrile
Property Insights of Ethyl(m-tolylazo)malononitrile
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl(m-tolylazo)malononitrile. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl(m-tolylazo)malononitrile. Following Lipinski's Rule of Five, Ethyl(m-tolylazo)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(m-tolylazo)malononitrile?
The CAS number of Ethyl(m-tolylazo)malononitrile is 3655-98-9.
What is the molecular formula of Ethyl(m-tolylazo)malononitrile?
The molecular formula of Ethyl(m-tolylazo)malononitrile is C12H12N4.
What is the molecular weight of Ethyl(m-tolylazo)malononitrile?
The molecular weight of Ethyl(m-tolylazo)malononitrile is 212.11 g/mol.
Where can I buy Ethyl(m-tolylazo)malononitrile?
You can request a quote for Ethyl(m-tolylazo)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl(m-tolylazo)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for Ethyl(m-tolylazo)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.