![[1,1'-Biphenyl]-2,2'-dicarbonitrile structure](/static/products/4443/444-31-5.webp)
[1,1'-Biphenyl]-2,2'-dicarbonitrile
TL;DR: [1,1'-Biphenyl]-2,2'-dicarbonitrile (CAS 444-31-5) is a chemical compound with molecular formula C14H8N2 and molecular weight 204.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-cyanophenyl)benzonitrile
Also Known As: [1,1'-Biphenyl]-2,2'-dicarbonitrile|2-(2-cyanophenyl)benzonitrile|Diphenonitrile|2,2'-Dicyanobiphenyl|o,o'-dicyanodiphenyl|[1,2'-dicarbonitrile|Perampanel Impurity 14|Perampanel Impurity 21|Maybridge3_000759|2,2 -Dicyanobiphenyl|2,2'-biphenyldicarbonitrile|2,2 -Bi(benzonitrile)|biphenyl-2,2'-dicarbonitrile|2,2 -Biphenyldicarbonitrile|Biphenyl-2,2 -dicarbonitrile|6004AB|1,1'-Biphenyl]-2,2'-dicarbonitrile|IDI1_012146|[1,1''-Biphenyl]-2,2''-dicarbonitrile|1,1 -Biphenyl-2,2 -dicarbonitrile
| Molecular Formula | C14H8N2 |
|---|---|
| Molecular Weight | 204.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.06874 |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 444-31-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C#N)C2=CC=CC=C2C#N |
| InChIKey | XDQREGRMKWTMOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[1,1'-Biphenyl]-2,2'-dicarbonitrile (CAS 444-31-5), with molecular formula C14H8N2 and molecular weight 204.07 g/mol. IUPAC: 2-(2-cyanophenyl)benzonitrile.
Chemical Property Profile of [1,1'-Biphenyl]-2,2'-dicarbonitrile
Property Insights of [1,1'-Biphenyl]-2,2'-dicarbonitrile
The XLogP value of 3.2 indicates that [1,1'-Biphenyl]-2,2'-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, [1,1'-Biphenyl]-2,2'-dicarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,1'-Biphenyl]-2,2'-dicarbonitrile has 0 hydrogen bond donor(s) and 2 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 [1,1'-Biphenyl]-2,2'-dicarbonitrile?
The CAS number of [1,1'-Biphenyl]-2,2'-dicarbonitrile is 444-31-5.
What is the molecular formula of [1,1'-Biphenyl]-2,2'-dicarbonitrile?
The molecular formula of [1,1'-Biphenyl]-2,2'-dicarbonitrile is C14H8N2.
What is the molecular weight of [1,1'-Biphenyl]-2,2'-dicarbonitrile?
The molecular weight of [1,1'-Biphenyl]-2,2'-dicarbonitrile is 204.07 g/mol.
Where can I buy [1,1'-Biphenyl]-2,2'-dicarbonitrile?
You can request a quote for [1,1'-Biphenyl]-2,2'-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,1'-Biphenyl]-2,2'-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for [1,1'-Biphenyl]-2,2'-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.