Aziridine-2-carbonitrile
TL;DR: Aziridine-2-carbonitrile (CAS 33898-53-2) is a chemical compound with molecular formula C3H4N2 and molecular weight 68.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aziridine-2-carbonitrile
Also Known As: Aziridine-2-carbonitrile, 2-Aziridinecarbonitrile, 2-Cyanoaziridine, 2-cyano-aziridine, 2,3-Iminopropionitrile
| Molecular Formula | C3H4N2 |
|---|---|
| Molecular Weight | 68.04 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 45.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 68.037445 |
| Heavy Atoms | 5 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 33898-53-2 |
|---|---|
| SMILES | C1C(N1)C#N |
| InChIKey | PGZUFTROELAOMP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aziridine-2-carbonitrile (CAS 33898-53-2), with molecular formula C3H4N2 and molecular weight 68.04 g/mol. IUPAC: aziridine-2-carbonitrile.
Chemical Property Profile of Aziridine-2-carbonitrile
Property Insights of Aziridine-2-carbonitrile
The XLogP value of -0.6 indicates that Aziridine-2-carbonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.7 Ų, Aziridine-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aziridine-2-carbonitrile has 1 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 Aziridine-2-carbonitrile?
The CAS number of Aziridine-2-carbonitrile is 33898-53-2.
What is the molecular formula of Aziridine-2-carbonitrile?
The molecular formula of Aziridine-2-carbonitrile is C3H4N2.
What is the molecular weight of Aziridine-2-carbonitrile?
The molecular weight of Aziridine-2-carbonitrile is 68.04 g/mol.
Where can I buy Aziridine-2-carbonitrile?
You can request a quote for Aziridine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aziridine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for Aziridine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.