Methyl(phenylazo)malononitrile
TL;DR: Methyl(phenylazo)malononitrile (CAS 3655-89-8) is a chemical compound with molecular formula C10H8N4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(phenyldiazenylmethyl)propanedinitrile
Also Known As: Methyl(phenylazo)malononitrile, Phenyl-azo-methyl-malonitril, Phenyl-azo-methyl-malonitril [German], MALONONITRILE, METHYL(PHENYLAZO)-, F 2279
| Molecular Formula | C10H8N4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07489 |
| Heavy Atoms | 14 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 3655-89-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=NCC(C#N)C#N |
| InChIKey | TYKXWUSYBPTIPC-UHFFFAOYSA-N |
Product Overview
Methyl(phenylazo)malononitrile (CAS 3655-89-8), with molecular formula C10H8N4 and molecular weight 184.07 g/mol. IUPAC: 2-(phenyldiazenylmethyl)propanedinitrile.
Chemical Property Profile of Methyl(phenylazo)malononitrile
Property Insights of Methyl(phenylazo)malononitrile
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl(phenylazo)malononitrile. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl(phenylazo)malononitrile. Following Lipinski's Rule of Five, Methyl(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 Methyl(phenylazo)malononitrile?
The CAS number of Methyl(phenylazo)malononitrile is 3655-89-8.
What is the molecular formula of Methyl(phenylazo)malononitrile?
The molecular formula of Methyl(phenylazo)malononitrile is C10H8N4.
What is the molecular weight of Methyl(phenylazo)malononitrile?
The molecular weight of Methyl(phenylazo)malononitrile is 184.07 g/mol.
Where can I buy Methyl(phenylazo)malononitrile?
You can request a quote for Methyl(phenylazo)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl(phenylazo)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for Methyl(phenylazo)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.