![3-[(2-Cyanoethyl)amino]-2-propenenitrile structure](/static/products/1082/108203-22-1.webp)
3-[(2-Cyanoethyl)amino]-2-propenenitrile
TL;DR: 3-[(2-Cyanoethyl)amino]-2-propenenitrile (CAS 108203-22-1) is a chemical compound with molecular formula C6H7N3 and molecular weight 121.063995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-cyanoethenylamino)propanenitrile
Also Known As: 3-(2-Cyanoethenylamino)propanenitrile, 3-[(2-Cyanoethyl)amino]-2-propenenitrile, 3-[(2-Cyanoethyl)amino]prop-2-enenitrile, 3-[[(E)-2-cyanoethenyl]amino]propanenitrile
Technical Specifications
| Molecular Formula | C6H7N3 |
| Molecular Weight | 121.063995 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 59.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 121.063995 Da |
| Heavy Atoms | 9 |
| Complexity | 175.0 |
| SMILES | C(CNC=CC#N)C#N |
| InChIKey | NCRBCUWCFKLBSA-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(2-Cyanoethyl)amino]-2-propenenitrile
Property Insights of 3-[(2-Cyanoethyl)amino]-2-propenenitrile
The XLogP value of -0.1 indicates that 3-[(2-Cyanoethyl)amino]-2-propenenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.6 Ų, 3-[(2-Cyanoethyl)amino]-2-propenenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(2-Cyanoethyl)amino]-2-propenenitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[(2-Cyanoethyl)amino]-2-propenenitrile?
The CAS number of 3-[(2-Cyanoethyl)amino]-2-propenenitrile is 108203-22-1.
What is the molecular formula of 3-[(2-Cyanoethyl)amino]-2-propenenitrile?
The molecular formula of 3-[(2-Cyanoethyl)amino]-2-propenenitrile is C6H7N3.
What is the molecular weight of 3-[(2-Cyanoethyl)amino]-2-propenenitrile?
The molecular weight of 3-[(2-Cyanoethyl)amino]-2-propenenitrile is 121.063995 g/mol.
Where can I buy 3-[(2-Cyanoethyl)amino]-2-propenenitrile?
You can request a quote for 3-[(2-Cyanoethyl)amino]-2-propenenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(2-Cyanoethyl)amino]-2-propenenitrile?
Yes, CoreyChem provides custom synthesis services for 3-[(2-Cyanoethyl)amino]-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.