![[(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile structure](/static/products/2567/25677-27-4.webp)
[(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile
TL;DR: [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile (CAS 25677-27-4) is a chemical compound with molecular formula C10H12N4 and molecular weight 188.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl-[(4-methylphenyl)diazenyl]amino]acetonitrile
Also Known As: 2-[methyl-[(4-methylphenyl)diazenyl]amino]acetonitrile, [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile
| Molecular Formula | C10H12N4 |
|---|---|
| Molecular Weight | 188.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.1062 |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 25677-27-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=NN(C)CC#N |
| InChIKey | PVXWBVJUJVNCQD-UHFFFAOYSA-N |
Product Overview
[(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile (CAS 25677-27-4), with molecular formula C10H12N4 and molecular weight 188.11 g/mol. IUPAC: 2-[methyl-[(4-methylphenyl)diazenyl]amino]acetonitrile.
Chemical Property Profile of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile
Property Insights of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile. With a topological polar surface area (TPSA) of 51.8 Ų, [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile 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 [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile?
The CAS number of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile is 25677-27-4.
What is the molecular formula of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile?
The molecular formula of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile is C10H12N4.
What is the molecular weight of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile?
The molecular weight of [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile is 188.11 g/mol.
Where can I buy [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile?
You can request a quote for [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for [(2E)-1-Methyl-3-(4-methylphenyl)triaz-2-en-1-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.