![3-[(2-Hydroxyethyl)thio]propanenitrile structure](/static/products/1577/15771-37-6.webp)
3-[(2-Hydroxyethyl)thio]propanenitrile
TL;DR: 3-[(2-Hydroxyethyl)thio]propanenitrile (CAS 15771-37-6) is a chemical compound with molecular formula C5H9NOS and molecular weight 131.04048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-hydroxyethylsulfanyl)propanenitrile
Also Known As: 3-((2-Hydroxyethyl)thio)propanenitrile, 3-(2-Hydroxyethylthio)Propionitrile, METHYLLINOLEATE, 3-(2-hydroxyethylsulfanyl)propanenitrile, 2-(2-Cyanoethylthio)ethanol
Technical Specifications
| Molecular Formula | C5H9NOS |
| Molecular Weight | 131.04048 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 131.04048 Da |
| Heavy Atoms | 8 |
| Complexity | 85.0 |
| SMILES | C(CSCCO)C#N |
| InChIKey | LNJCGNRKWOHFFV-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(2-Hydroxyethyl)thio]propanenitrile
Property Insights of 3-[(2-Hydroxyethyl)thio]propanenitrile
The XLogP value of -0.1 indicates that 3-[(2-Hydroxyethyl)thio]propanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Hydroxyethyl)thio]propanenitrile. Following Lipinski's Rule of Five, 3-[(2-Hydroxyethyl)thio]propanenitrile 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-Hydroxyethyl)thio]propanenitrile?
The CAS number of 3-[(2-Hydroxyethyl)thio]propanenitrile is 15771-37-6.
What is the molecular formula of 3-[(2-Hydroxyethyl)thio]propanenitrile?
The molecular formula of 3-[(2-Hydroxyethyl)thio]propanenitrile is C5H9NOS.
What is the molecular weight of 3-[(2-Hydroxyethyl)thio]propanenitrile?
The molecular weight of 3-[(2-Hydroxyethyl)thio]propanenitrile is 131.04048 g/mol.
Where can I buy 3-[(2-Hydroxyethyl)thio]propanenitrile?
You can request a quote for 3-[(2-Hydroxyethyl)thio]propanenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(2-Hydroxyethyl)thio]propanenitrile?
Yes, CoreyChem provides custom synthesis services for 3-[(2-Hydroxyethyl)thio]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.