![4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile structure](/static/products/3012/301211-98-3.webp)
4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile
TL;DR: 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile (CAS 301211-98-3) is a chemical compound with molecular formula C22H16N2O and molecular weight 324.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile
Also Known As: BAS 00121984, 4-(3,4'-Dimethyl-biphenyl-4-yloxy)-phthalonitrile, 4-[2-methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile, 4-(3,4/'-Dimethyl-biphenyl-4-yloxy)-phthalonitrile, 4-[(3,4'-dimethyl[1,1'-biphenyl]-4-yl)oxy]phthalonitrile
| Molecular Formula | C22H16N2O |
|---|---|
| Molecular Weight | 324.13 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.12625 |
| Heavy Atoms | 25 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 301211-98-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)C |
| InChIKey | JOEZTWVOIGQGQF-UHFFFAOYSA-N |
Product Overview
4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile (CAS 301211-98-3), with molecular formula C22H16N2O and molecular weight 324.13 g/mol. IUPAC: 4-[2-methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile.
Chemical Property Profile of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile
Property Insights of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile
The XLogP value of 5.2 indicates that 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.8 Ų, 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile?
The CAS number of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile is 301211-98-3.
What is the molecular formula of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile?
The molecular formula of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile is C22H16N2O.
What is the molecular weight of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile?
The molecular weight of 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile is 324.13 g/mol.
Where can I buy 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile?
You can request a quote for 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-Methyl-4-(4-methylphenyl)phenoxy]benzene-1,2-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.