![3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile structure](/static/products/3012/301212-02-2.webp)
3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile
TL;DR: 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile (CAS 301212-02-2) is a chemical compound with molecular formula C23H12N4O2 and molecular weight 376.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(2,3-dicyanophenoxy)-5-methylphenoxy]benzene-1,2-dicarbonitrile
Also Known As: BAS 00121986, AB01334783-02, 3,3'-[(5-Methyl-1,3-phenylene)bis(oxy)]diphthalonitrile, 3-[3-(2,3-DICYANOPHENOXY)-5-METHYLPHENOXY]PHTHALONITRILE, 3-[3-(2,3-dicyanophenoxy)-5-methylphenoxy]benzene-1,2-dicarbonitrile
| Molecular Formula | C23H12N4O2 |
|---|---|
| Molecular Weight | 376.10 g/mol |
| LogP | 5.06634 |
| Topological Polar Surface Area | 113.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.09604 |
| Heavy Atoms | 29 |
| Complexity | 1172.2413 |
Chemical Identifiers
| CAS Number | 301212-02-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OC2=CC=CC(=C2C#N)C#N)OC3=CC=CC(=C3C#N)C#N |
Product Overview
3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile (CAS 301212-02-2), with molecular formula C23H12N4O2 and molecular weight 376.10 g/mol. IUPAC: 3-[3-(2,3-dicyanophenoxy)-5-methylphenoxy]benzene-1,2-dicarbonitrile.
Chemical Property Profile of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile
Property Insights of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile
The XLogP value of 5.06634 indicates that 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile. Following Lipinski's Rule of Five, 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile?
The CAS number of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile is 301212-02-2.
What is the molecular formula of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile?
The molecular formula of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile is C23H12N4O2.
What is the molecular weight of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile?
The molecular weight of 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile is 376.10 g/mol.
Where can I buy 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile?
You can request a quote for 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(2,3-Dicyanophenoxy)-5-methylphenoxy]phthalonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.