Methyl(p-tolylazo)malononitrile
TL;DR: Methyl(p-tolylazo)malononitrile (CAS 3655-91-2) 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-[[(4-methylphenyl)diazenyl]methyl]propanedinitrile
Also Known As: Methyl(p-tolylazo)malononitrile, 4-Tolyl-azo-methyl-malonitril, 4-Tolyl-azo-methyl-malonitril [German], MALONONITRILE, METHYL(p-TOLYLAZO)-, F 2282
| 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 | 3 |
| Exact Mass | 198.09055 |
| Heavy Atoms | 15 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 3655-91-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=NCC(C#N)C#N |
| InChIKey | FLWGHIQWLJWDFE-UHFFFAOYSA-N |
Product Overview
Methyl(p-tolylazo)malononitrile (CAS 3655-91-2), with molecular formula C11H10N4 and molecular weight 198.09 g/mol. IUPAC: 2-[[(4-methylphenyl)diazenyl]methyl]propanedinitrile.
Chemical Property Profile of Methyl(p-tolylazo)malononitrile
Property Insights of Methyl(p-tolylazo)malononitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl(p-tolylazo)malononitrile. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl(p-tolylazo)malononitrile. Following Lipinski's Rule of Five, Methyl(p-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 Methyl(p-tolylazo)malononitrile?
The CAS number of Methyl(p-tolylazo)malononitrile is 3655-91-2.
What is the molecular formula of Methyl(p-tolylazo)malononitrile?
The molecular formula of Methyl(p-tolylazo)malononitrile is C11H10N4.
What is the molecular weight of Methyl(p-tolylazo)malononitrile?
The molecular weight of Methyl(p-tolylazo)malononitrile is 198.09 g/mol.
Where can I buy Methyl(p-tolylazo)malononitrile?
You can request a quote for Methyl(p-tolylazo)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl(p-tolylazo)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for Methyl(p-tolylazo)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.