Benzonitrile, 4,4'-oxybis-
TL;DR: Benzonitrile, 4,4'-oxybis- (CAS 6508-04-9) is a chemical compound with molecular formula C14H8N2O and molecular weight 220.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-cyanophenoxy)benzonitrile
Also Known As: 4-Cyanophenyl ether, 4,4'-Oxydibenzonitrile, Bis(4-cyanophenyl) Ether, 4-(4-cyanophenoxy)benzonitrile, Benzonitrile, 4,4'-oxybis-
| Molecular Formula | C14H8N2O |
|---|---|
| Molecular Weight | 220.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.06366 |
| Heavy Atoms | 17 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 6508-04-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)C#N |
| InChIKey | RSAUOQFEFINEDM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzonitrile, 4,4'-oxybis- (CAS 6508-04-9), with molecular formula C14H8N2O and molecular weight 220.06 g/mol. IUPAC: 4-(4-cyanophenoxy)benzonitrile.
Chemical Property Profile of Benzonitrile, 4,4'-oxybis-
Property Insights of Benzonitrile, 4,4'-oxybis-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzonitrile, 4,4'-oxybis-. With a topological polar surface area (TPSA) of 56.8 Ų, Benzonitrile, 4,4'-oxybis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzonitrile, 4,4'-oxybis- has 0 hydrogen bond donor(s) and 3 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 Benzonitrile, 4,4'-oxybis-?
The CAS number of Benzonitrile, 4,4'-oxybis- is 6508-04-9.
What is the molecular formula of Benzonitrile, 4,4'-oxybis-?
The molecular formula of Benzonitrile, 4,4'-oxybis- is C14H8N2O.
What is the molecular weight of Benzonitrile, 4,4'-oxybis-?
The molecular weight of Benzonitrile, 4,4'-oxybis- is 220.06 g/mol.
Where can I buy Benzonitrile, 4,4'-oxybis-?
You can request a quote for Benzonitrile, 4,4'-oxybis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzonitrile, 4,4'-oxybis-?
Yes, KEHONG BIO provides custom synthesis services for Benzonitrile, 4,4'-oxybis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.