Benzyl(o-tolylazo)malononitrile
TL;DR: Benzyl(o-tolylazo)malononitrile (CAS 3701-10-8) is a chemical compound with molecular formula C17H14N4 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2-methylphenyl)diazenyl]-phenylmethyl]propanedinitrile
Also Known As: Benzyl(o-tolylazo)malononitrile, 2-Tolyl-azo-benzyl-malonitril, 2-Tolyl-azo-benzyl-malonitril [German], MALONONITRILE, BENZYL(o-TOLYLAZO)-, F 2296
| Molecular Formula | C17H14N4 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.12186 |
| Heavy Atoms | 21 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 3701-10-8 |
|---|---|
| SMILES | CC1=CC=CC=C1N=NC(C2=CC=CC=C2)C(C#N)C#N |
| InChIKey | OLRQMSMZSFSTAI-UHFFFAOYSA-N |
Product Overview
Benzyl(o-tolylazo)malononitrile (CAS 3701-10-8), with molecular formula C17H14N4 and molecular weight 274.12 g/mol. IUPAC: 2-[[(2-methylphenyl)diazenyl]-phenylmethyl]propanedinitrile.
Chemical Property Profile of Benzyl(o-tolylazo)malononitrile
Property Insights of Benzyl(o-tolylazo)malononitrile
The XLogP value of 3.7 indicates that Benzyl(o-tolylazo)malononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl(o-tolylazo)malononitrile. Following Lipinski's Rule of Five, Benzyl(o-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 Benzyl(o-tolylazo)malononitrile?
The CAS number of Benzyl(o-tolylazo)malononitrile is 3701-10-8.
What is the molecular formula of Benzyl(o-tolylazo)malononitrile?
The molecular formula of Benzyl(o-tolylazo)malononitrile is C17H14N4.
What is the molecular weight of Benzyl(o-tolylazo)malononitrile?
The molecular weight of Benzyl(o-tolylazo)malononitrile is 274.12 g/mol.
Where can I buy Benzyl(o-tolylazo)malononitrile?
You can request a quote for Benzyl(o-tolylazo)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl(o-tolylazo)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for Benzyl(o-tolylazo)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.