((p-Ethoxyphenyl)azo)methylmalononitrile
TL;DR: ((p-Ethoxyphenyl)azo)methylmalononitrile (CAS 1867-35-2) is a chemical compound with molecular formula C12H12N4O and molecular weight 228.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(4-ethoxyphenyl)diazenyl]methyl]propanedinitrile
Also Known As: ((p-Ethoxyphenyl)azo)methylmalononitrile, 4-Aethoxy-phenyl-azo-methyl-malonitril, F 2286, Propanedinitrile, ((4-ethoxyphenyl)azo)methyl-, 4-Aethoxy-phenyl-azo-methyl-malonitril [German]
| Molecular Formula | C12H12N4O |
|---|---|
| Molecular Weight | 228.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 228.1011 |
| Heavy Atoms | 17 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 1867-35-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N=NCC(C#N)C#N |
| InChIKey | LMAOOSJNNQFIMI-UHFFFAOYSA-N |
Product Overview
((p-Ethoxyphenyl)azo)methylmalononitrile (CAS 1867-35-2), with molecular formula C12H12N4O and molecular weight 228.10 g/mol. IUPAC: 2-[[(4-ethoxyphenyl)diazenyl]methyl]propanedinitrile.
Chemical Property Profile of ((p-Ethoxyphenyl)azo)methylmalononitrile
Property Insights of ((p-Ethoxyphenyl)azo)methylmalononitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((p-Ethoxyphenyl)azo)methylmalononitrile. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ((p-Ethoxyphenyl)azo)methylmalononitrile. Following Lipinski's Rule of Five, ((p-Ethoxyphenyl)azo)methylmalononitrile has 0 hydrogen bond donor(s) and 5 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 ((p-Ethoxyphenyl)azo)methylmalononitrile?
The CAS number of ((p-Ethoxyphenyl)azo)methylmalononitrile is 1867-35-2.
What is the molecular formula of ((p-Ethoxyphenyl)azo)methylmalononitrile?
The molecular formula of ((p-Ethoxyphenyl)azo)methylmalononitrile is C12H12N4O.
What is the molecular weight of ((p-Ethoxyphenyl)azo)methylmalononitrile?
The molecular weight of ((p-Ethoxyphenyl)azo)methylmalononitrile is 228.10 g/mol.
Where can I buy ((p-Ethoxyphenyl)azo)methylmalononitrile?
You can request a quote for ((p-Ethoxyphenyl)azo)methylmalononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((p-Ethoxyphenyl)azo)methylmalononitrile?
Yes, KEHONG BIO provides custom synthesis services for ((p-Ethoxyphenyl)azo)methylmalononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.