Azetidine-1-carbonitrile
TL;DR: Azetidine-1-carbonitrile (CAS 76098-72-1) is a chemical compound with molecular formula C4H6N2 and molecular weight 82.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azetidine-1-carbonitrile
Also Known As: Azetidine-1-carbonitrile, 1-Azetidinecarbonitrile
| Molecular Formula | C4H6N2 |
|---|---|
| Molecular Weight | 82.05 g/mol |
| LogP | 0.17318 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 82.0531 |
| Heavy Atoms | 6 |
| Complexity | 78.0391 |
Chemical Identifiers
| CAS Number | 76098-72-1 |
|---|---|
| SMILES | C1CN(C1)C#N |
Product Overview
Azetidine-1-carbonitrile (CAS 76098-72-1), with molecular formula C4H6N2 and molecular weight 82.05 g/mol. IUPAC: azetidine-1-carbonitrile.
Chemical Property Profile of Azetidine-1-carbonitrile
Property Insights of Azetidine-1-carbonitrile
The XLogP value of 0.17318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azetidine-1-carbonitrile. With a topological polar surface area (TPSA) of 27.03 Ų, Azetidine-1-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azetidine-1-carbonitrile 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 Azetidine-1-carbonitrile?
The CAS number of Azetidine-1-carbonitrile is 76098-72-1.
What is the molecular formula of Azetidine-1-carbonitrile?
The molecular formula of Azetidine-1-carbonitrile is C4H6N2.
What is the molecular weight of Azetidine-1-carbonitrile?
The molecular weight of Azetidine-1-carbonitrile is 82.05 g/mol.
Where can I buy Azetidine-1-carbonitrile?
You can request a quote for Azetidine-1-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azetidine-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for Azetidine-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.