Cyanocyclobutane
TL;DR: Cyanocyclobutane (CAS 4426-11-3) is a chemical compound with molecular formula C5H7N and molecular weight 81.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclobutanecarbonitrile
Also Known As: Cyclobutanecarbonitrile, Cyanocyclobutane, Cyclobutyl cyanide, cyclobutancarbonitrile, cyclobutane carbonitrile
| Molecular Formula | C5H7N |
|---|---|
| Molecular Weight | 81.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 81.057846 |
| Heavy Atoms | 6 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 4426-11-3 |
|---|---|
| SMILES | C1CC(C1)C#N |
| InChIKey | GFBLFDSCAKHHGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyanocyclobutane (CAS 4426-11-3), with molecular formula C5H7N and molecular weight 81.06 g/mol. IUPAC: cyclobutanecarbonitrile.
Chemical Property Profile of Cyanocyclobutane
Property Insights of Cyanocyclobutane
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyanocyclobutane. With a topological polar surface area (TPSA) of 23.8 Ų, Cyanocyclobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyanocyclobutane has 0 hydrogen bond donor(s) and 1 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 Cyanocyclobutane?
The CAS number of Cyanocyclobutane is 4426-11-3.
What is the molecular formula of Cyanocyclobutane?
The molecular formula of Cyanocyclobutane is C5H7N.
What is the molecular weight of Cyanocyclobutane?
The molecular weight of Cyanocyclobutane is 81.06 g/mol.
Where can I buy Cyanocyclobutane?
You can request a quote for Cyanocyclobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyanocyclobutane?
Yes, KEHONG BIO provides custom synthesis services for Cyanocyclobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.